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1812.05992
Soraida Fiol Gonzalez
Soraida Fiol Gonz\'alez
La fauna de mam\'iferos f\'osiles del dep\'osito paleontol\'ogico "El Abr\'on" (nivel ix), Pinar del R\'io, Cuba
in Spanish. Advisor: Joao G. Mart\'inez L\'opez
null
null
null
q-bio.OT
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
"El Abr\'on" is a fossil deposit located in Pinar del Rio, Cuba, and whose age is only reference level VII (17 406 years BP), it is classified as the largest collection of fossils accumulated for our archipelago, produced by trophic action of barn owls for thousands of years. The aim of this study was to determine the living taxonomic composition of the fauna of extinct mammals, and throughout the paleontological study of the deeper level of said tank (Level IX). The extracted material which it is currently stored in the warehouse of paleontological collections of the National Museum of Natural History in Havana, Cuba (MNHNCu) was analyzed. We proceeded to clean the bones, to classify and to identify them from the species and also the taphonomic analysis of the condition of the remains. It was found that the mammal fauna of the paleontological deposit under study is composed essentially of 3 orders, 7 families and 14 species. The most significative order is Chiroptera (bat fauna), represented by 4 families, 9 genus and 9 species of the total which were identified. There were reported four species of bats Erophylla sezecorni, Monophyllus redmani, Pteronotus parnelli and Tadarida brasiliensis in the location. The results are the basis of the future paleoecological studies in order to reconstruct the natural history of these species. Moreover, the discovery of new species in this area is a contribution to the knowledge about the distribution of these species in the Cuban archipelago and the age of them. Finally, the taphonomic analysis of the conservation status of these remains permitted the understanding of the processes that gave rise to the tank and its characteristics, and also it contribute to an adequate estimation of the species present in it and the relationship between spatiotemporal with the fossil.
[ { "created": "Fri, 14 Dec 2018 15:53:01 GMT", "version": "v1" } ]
2018-12-17
[ [ "González", "Soraida Fiol", "" ] ]
"El Abr\'on" is a fossil deposit located in Pinar del Rio, Cuba, and whose age is only reference level VII (17 406 years BP), it is classified as the largest collection of fossils accumulated for our archipelago, produced by trophic action of barn owls for thousands of years. The aim of this study was to determine the living taxonomic composition of the fauna of extinct mammals, and throughout the paleontological study of the deeper level of said tank (Level IX). The extracted material which it is currently stored in the warehouse of paleontological collections of the National Museum of Natural History in Havana, Cuba (MNHNCu) was analyzed. We proceeded to clean the bones, to classify and to identify them from the species and also the taphonomic analysis of the condition of the remains. It was found that the mammal fauna of the paleontological deposit under study is composed essentially of 3 orders, 7 families and 14 species. The most significative order is Chiroptera (bat fauna), represented by 4 families, 9 genus and 9 species of the total which were identified. There were reported four species of bats Erophylla sezecorni, Monophyllus redmani, Pteronotus parnelli and Tadarida brasiliensis in the location. The results are the basis of the future paleoecological studies in order to reconstruct the natural history of these species. Moreover, the discovery of new species in this area is a contribution to the knowledge about the distribution of these species in the Cuban archipelago and the age of them. Finally, the taphonomic analysis of the conservation status of these remains permitted the understanding of the processes that gave rise to the tank and its characteristics, and also it contribute to an adequate estimation of the species present in it and the relationship between spatiotemporal with the fossil.
1308.0551
Jaeyun Sung
Jaeyun Sung, Pan-Jun Kim, Shuyi Ma, Cory C. Funk, Andrew T. Magis, Yuliang Wang, Leroy Hood, Donald Geman, and Nathan D. Price
Multi-study Integration of Brain Cancer Transcriptomes Reveals Organ-Level Molecular Signatures
27 pages of main text including 4 figures and 4 tables. 32 pages of supplementary material (Text, Figures, and Tables)
PLoS Comput Biol 9(7): e1003148 (2013)
10.1371/journal.pcbi.1003148
null
q-bio.QM
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
We utilized abundant transcriptomic data for the primary classes of brain cancers to study the feasibility of separating all of these diseases simultaneously based on molecular data alone. These signatures were based on a new method reported herein that resulted in a brain cancer marker panel of 44 unique genes. Many of these genes have established relevance to the brain cancers examined, with others having known roles in cancer biology. Analyses on large-scale data from multiple sources must deal with significant challenges associated with heterogeneity between different published studies, for it was observed that the variation among individual studies often had a larger effect on the transcriptome than did phenotype differences, as is typical. We found that learning signatures across multiple datasets greatly enhanced reproducibility and accuracy in predictive performance on truly independent validation sets, even when keeping the size of the training set the same. This was most likely due to the meta-signature encompassing more of the heterogeneity across different sources and conditions, while amplifying signal from the repeated global characteristics of the phenotype. When molecular signatures of brain cancers were constructed from all currently available microarray data, 90 percent phenotype prediction accuracy, or the accuracy of identifying a particular brain cancer from the background of all phenotypes, was found. Looking forward, we discuss our approach in the context of the eventual development of organ-specific molecular signatures from peripheral fluids such as the blood.
[ { "created": "Fri, 2 Aug 2013 16:53:23 GMT", "version": "v1" } ]
2013-08-05
[ [ "Sung", "Jaeyun", "" ], [ "Kim", "Pan-Jun", "" ], [ "Ma", "Shuyi", "" ], [ "Funk", "Cory C.", "" ], [ "Magis", "Andrew T.", "" ], [ "Wang", "Yuliang", "" ], [ "Hood", "Leroy", "" ], [ "Geman", "...
We utilized abundant transcriptomic data for the primary classes of brain cancers to study the feasibility of separating all of these diseases simultaneously based on molecular data alone. These signatures were based on a new method reported herein that resulted in a brain cancer marker panel of 44 unique genes. Many of these genes have established relevance to the brain cancers examined, with others having known roles in cancer biology. Analyses on large-scale data from multiple sources must deal with significant challenges associated with heterogeneity between different published studies, for it was observed that the variation among individual studies often had a larger effect on the transcriptome than did phenotype differences, as is typical. We found that learning signatures across multiple datasets greatly enhanced reproducibility and accuracy in predictive performance on truly independent validation sets, even when keeping the size of the training set the same. This was most likely due to the meta-signature encompassing more of the heterogeneity across different sources and conditions, while amplifying signal from the repeated global characteristics of the phenotype. When molecular signatures of brain cancers were constructed from all currently available microarray data, 90 percent phenotype prediction accuracy, or the accuracy of identifying a particular brain cancer from the background of all phenotypes, was found. Looking forward, we discuss our approach in the context of the eventual development of organ-specific molecular signatures from peripheral fluids such as the blood.
1103.0342
Bin Wu
Jing Wang, Bin Wu, Daniel W. C. Ho, Long Wang
Evolution of cooperation in multilevel public goods games with community structures
6 pages, 4 figures, Accepted by EPL
null
10.1209/0295-5075/93/58001
null
q-bio.PE
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
In a community-structured population, public goods games (PGG) occur both within and between communities. Such type of PGG is referred as multilevel public goods games (MPGG). We propose a minimalist evolutionary model of the MPGG and analytically study the evolution of cooperation. We demonstrate that in the case of sufficiently large community size and community number, if the imitation strength within community is weak, i.e., an individual imitates another one in the same community almost randomly, cooperation as well as punishment are more abundant than defection in the long run; if the imitation strength between communities is strong, i.e., the more successful strategy in two individuals from distinct communities is always imitated, cooperation and punishment are also more abundant. However, when both of the two imitation intensities are strong, defection becomes the most abundant strategy in the population. Our model provides insight into the investigation of the large-scale cooperation in public social dilemma among contemporary communities.
[ { "created": "Wed, 2 Mar 2011 03:30:50 GMT", "version": "v1" } ]
2015-05-27
[ [ "Wang", "Jing", "" ], [ "Wu", "Bin", "" ], [ "Ho", "Daniel W. C.", "" ], [ "Wang", "Long", "" ] ]
In a community-structured population, public goods games (PGG) occur both within and between communities. Such type of PGG is referred as multilevel public goods games (MPGG). We propose a minimalist evolutionary model of the MPGG and analytically study the evolution of cooperation. We demonstrate that in the case of sufficiently large community size and community number, if the imitation strength within community is weak, i.e., an individual imitates another one in the same community almost randomly, cooperation as well as punishment are more abundant than defection in the long run; if the imitation strength between communities is strong, i.e., the more successful strategy in two individuals from distinct communities is always imitated, cooperation and punishment are also more abundant. However, when both of the two imitation intensities are strong, defection becomes the most abundant strategy in the population. Our model provides insight into the investigation of the large-scale cooperation in public social dilemma among contemporary communities.
2401.14819
Philip Hartout
Dexiong Chen, Philip Hartout, Paolo Pellizzoni, Carlos Oliver, Karsten Borgwardt
Endowing Protein Language Models with Structural Knowledge
null
null
null
null
q-bio.QM cs.LG q-bio.BM
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
Understanding the relationships between protein sequence, structure and function is a long-standing biological challenge with manifold implications from drug design to our understanding of evolution. Recently, protein language models have emerged as the preferred method for this challenge, thanks to their ability to harness large sequence databases. Yet, their reliance on expansive sequence data and parameter sets limits their flexibility and practicality in real-world scenarios. Concurrently, the recent surge in computationally predicted protein structures unlocks new opportunities in protein representation learning. While promising, the computational burden carried by such complex data still hinders widely-adopted practical applications. To address these limitations, we introduce a novel framework that enhances protein language models by integrating protein structural data. Drawing from recent advances in graph transformers, our approach refines the self-attention mechanisms of pretrained language transformers by integrating structural information with structure extractor modules. This refined model, termed Protein Structure Transformer (PST), is further pretrained on a small protein structure database, using the same masked language modeling objective as traditional protein language models. Empirical evaluations of PST demonstrate its superior parameter efficiency relative to protein language models, despite being pretrained on a dataset comprising only 542K structures. Notably, PST consistently outperforms the state-of-the-art foundation model for protein sequences, ESM-2, setting a new benchmark in protein function prediction. Our findings underscore the potential of integrating structural information into protein language models, paving the way for more effective and efficient protein modeling Code and pretrained models are available at https://github.com/BorgwardtLab/PST.
[ { "created": "Fri, 26 Jan 2024 12:47:54 GMT", "version": "v1" } ]
2024-01-29
[ [ "Chen", "Dexiong", "" ], [ "Hartout", "Philip", "" ], [ "Pellizzoni", "Paolo", "" ], [ "Oliver", "Carlos", "" ], [ "Borgwardt", "Karsten", "" ] ]
Understanding the relationships between protein sequence, structure and function is a long-standing biological challenge with manifold implications from drug design to our understanding of evolution. Recently, protein language models have emerged as the preferred method for this challenge, thanks to their ability to harness large sequence databases. Yet, their reliance on expansive sequence data and parameter sets limits their flexibility and practicality in real-world scenarios. Concurrently, the recent surge in computationally predicted protein structures unlocks new opportunities in protein representation learning. While promising, the computational burden carried by such complex data still hinders widely-adopted practical applications. To address these limitations, we introduce a novel framework that enhances protein language models by integrating protein structural data. Drawing from recent advances in graph transformers, our approach refines the self-attention mechanisms of pretrained language transformers by integrating structural information with structure extractor modules. This refined model, termed Protein Structure Transformer (PST), is further pretrained on a small protein structure database, using the same masked language modeling objective as traditional protein language models. Empirical evaluations of PST demonstrate its superior parameter efficiency relative to protein language models, despite being pretrained on a dataset comprising only 542K structures. Notably, PST consistently outperforms the state-of-the-art foundation model for protein sequences, ESM-2, setting a new benchmark in protein function prediction. Our findings underscore the potential of integrating structural information into protein language models, paving the way for more effective and efficient protein modeling Code and pretrained models are available at https://github.com/BorgwardtLab/PST.
2406.13839
Chaitanya K. Joshi
Rishabh Anand, Chaitanya K. Joshi, Alex Morehead, Arian R. Jamasb, Charles Harris, Simon V. Mathis, Kieran Didi, Bryan Hooi, Pietro Li\`o
RNA-FrameFlow: Flow Matching for de novo 3D RNA Backbone Design
To be presented as an Oral at ICML 2024 Structured Probabilistic Inference & Generative Modeling Workshop, and a Spotlight at ICML 2024 AI4Science Workshop
null
null
null
q-bio.BM cs.LG q-bio.GN
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
We introduce RNA-FrameFlow, the first generative model for 3D RNA backbone design. We build upon SE(3) flow matching for protein backbone generation and establish protocols for data preparation and evaluation to address unique challenges posed by RNA modeling. We formulate RNA structures as a set of rigid-body frames and associated loss functions which account for larger, more conformationally flexible RNA backbones (13 atoms per nucleotide) vs. proteins (4 atoms per residue). Toward tackling the lack of diversity in 3D RNA datasets, we explore training with structural clustering and cropping augmentations. Additionally, we define a suite of evaluation metrics to measure whether the generated RNA structures are globally self-consistent (via inverse folding followed by forward folding) and locally recover RNA-specific structural descriptors. The most performant version of RNA-FrameFlow generates locally realistic RNA backbones of 40-150 nucleotides, over 40% of which pass our validity criteria as measured by a self-consistency TM-score >= 0.45, at which two RNAs have the same global fold. Open-source code: https://github.com/rish-16/rna-backbone-design
[ { "created": "Wed, 19 Jun 2024 21:06:44 GMT", "version": "v1" } ]
2024-06-21
[ [ "Anand", "Rishabh", "" ], [ "Joshi", "Chaitanya K.", "" ], [ "Morehead", "Alex", "" ], [ "Jamasb", "Arian R.", "" ], [ "Harris", "Charles", "" ], [ "Mathis", "Simon V.", "" ], [ "Didi", "Kieran", "" ], ...
We introduce RNA-FrameFlow, the first generative model for 3D RNA backbone design. We build upon SE(3) flow matching for protein backbone generation and establish protocols for data preparation and evaluation to address unique challenges posed by RNA modeling. We formulate RNA structures as a set of rigid-body frames and associated loss functions which account for larger, more conformationally flexible RNA backbones (13 atoms per nucleotide) vs. proteins (4 atoms per residue). Toward tackling the lack of diversity in 3D RNA datasets, we explore training with structural clustering and cropping augmentations. Additionally, we define a suite of evaluation metrics to measure whether the generated RNA structures are globally self-consistent (via inverse folding followed by forward folding) and locally recover RNA-specific structural descriptors. The most performant version of RNA-FrameFlow generates locally realistic RNA backbones of 40-150 nucleotides, over 40% of which pass our validity criteria as measured by a self-consistency TM-score >= 0.45, at which two RNAs have the same global fold. Open-source code: https://github.com/rish-16/rna-backbone-design
1706.09570
Nithin Nagaraj
Suresh Jois and Nithin Nagaraj
Simulation Study of Two Measures of Integrated Information
10 pages, 3 figures. The work reported in this paper, in summary form, was presented as a poster at The Science of Consciousness (TSC) Conference, June 5-10, held at La Jolla, USA
null
null
null
q-bio.NC
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
Background: Many authors have proposed Quantitative Theories of Consciousness (QTC) based on theoretical principles like information theory, Granger causality and complexity. Recently, Virmani and Nagaraj (arXiv:1608.08450v2 [cs.IT]) noted the similarity between Integrated Information and Compression-Complexity, and on this basis, proposed a novel measure of network complexity called Phi-Compression Complexity (Phi-C or $\Phi^C$). Their computer simulations using Boolean networks showed that $\Phi^C$ compares favorably to Giulio Tononi et al's Integrated Information measure $\Phi$ 3.0 and exhibits desirable mathematical and computational characteristics. Methods: In the present work, $\Phi^C$ was measured for two types of simulated networks: (A) Networks representing simple neuronal connectivity motifs (presented in Fig.9 of Tononi and Sporns, BMC Neuroscience 4(1), 2003); (B) random networks derived from Erd\"os-R \'enyi G(N, p)graphs. Code for all simulations was written in Python 3.6, and the library NetworkX was used to simulate the graphs. Results and discussions summary: In simulations A, for the same set of networks, $\Phi^C$ values differ from the values of IIT 1.0 $\Phi$ in a counter-intuitive manner. It appears that $\Phi^C$ captures some invariant aspects of the interplay between information integration, network topology, graph composition and node entropy. While Virmani and Nagaraj (arXiv:1608.08450v2 [cs.IT]) sought to highlight the correlations between $\Phi^C$ and IIT $\Phi$, the results of simulations A highlight the differences between the two measures in the way they capture the integrated information. In simulations B, the results of simulations A are extended to the more general case of random networks. In the concluding section we outline the novel aspects of this paper, and our ongoing and future research.
[ { "created": "Thu, 29 Jun 2017 04:06:01 GMT", "version": "v1" } ]
2017-06-30
[ [ "Jois", "Suresh", "" ], [ "Nagaraj", "Nithin", "" ] ]
Background: Many authors have proposed Quantitative Theories of Consciousness (QTC) based on theoretical principles like information theory, Granger causality and complexity. Recently, Virmani and Nagaraj (arXiv:1608.08450v2 [cs.IT]) noted the similarity between Integrated Information and Compression-Complexity, and on this basis, proposed a novel measure of network complexity called Phi-Compression Complexity (Phi-C or $\Phi^C$). Their computer simulations using Boolean networks showed that $\Phi^C$ compares favorably to Giulio Tononi et al's Integrated Information measure $\Phi$ 3.0 and exhibits desirable mathematical and computational characteristics. Methods: In the present work, $\Phi^C$ was measured for two types of simulated networks: (A) Networks representing simple neuronal connectivity motifs (presented in Fig.9 of Tononi and Sporns, BMC Neuroscience 4(1), 2003); (B) random networks derived from Erd\"os-R \'enyi G(N, p)graphs. Code for all simulations was written in Python 3.6, and the library NetworkX was used to simulate the graphs. Results and discussions summary: In simulations A, for the same set of networks, $\Phi^C$ values differ from the values of IIT 1.0 $\Phi$ in a counter-intuitive manner. It appears that $\Phi^C$ captures some invariant aspects of the interplay between information integration, network topology, graph composition and node entropy. While Virmani and Nagaraj (arXiv:1608.08450v2 [cs.IT]) sought to highlight the correlations between $\Phi^C$ and IIT $\Phi$, the results of simulations A highlight the differences between the two measures in the way they capture the integrated information. In simulations B, the results of simulations A are extended to the more general case of random networks. In the concluding section we outline the novel aspects of this paper, and our ongoing and future research.
2203.02438
Zachary Kilpatrick PhD
Heather L Cihak, Tahra L Eissa, and Zachary P Kilpatrick
Distinct excitatory and inhibitory bump wandering in a stochastic neural field
28 pages; 10 figures
null
null
null
q-bio.NC nlin.PS
http://creativecommons.org/licenses/by/4.0/
Localized persistent cortical neural activity is a validated neural substrate of parametric working memory. Such activity `bumps' represent the continuous location of a cue over several seconds. Pyramidal (excitatory) and interneuronal (inhibitory) subpopulations exhibit tuned bumps of activity, linking neural dynamics to behavioral inaccuracies observed in memory recall. However, many bump attractor models collapse these subpopulations into a single joint excitatory/inhibitory (lateral inhibitory) population, and do not consider the role of interpopulation neural architecture and noise correlations. Both factors have a high potential to impinge upon the stochastic dynamics of these bumps, ultimately shaping behavioral response variance. In our study, we consider a neural field model with separate excitatory/inhibitory (E/I) populations and leverage asymptotic analysis to derive a nonlinear Langevin system describing E/I bump interactions. While the E bump attracts the I bump, the I bump stabilizes but can also repel the E bump, which can result in prolonged relaxation dynamics when both bumps are perturbed. Furthermore, the structure of noise correlations within and between subpopulations strongly shapes the variance in bump position. Surprisingly, higher interpopulation correlations reduce variance.
[ { "created": "Fri, 4 Mar 2022 17:14:13 GMT", "version": "v1" } ]
2022-03-07
[ [ "Cihak", "Heather L", "" ], [ "Eissa", "Tahra L", "" ], [ "Kilpatrick", "Zachary P", "" ] ]
Localized persistent cortical neural activity is a validated neural substrate of parametric working memory. Such activity `bumps' represent the continuous location of a cue over several seconds. Pyramidal (excitatory) and interneuronal (inhibitory) subpopulations exhibit tuned bumps of activity, linking neural dynamics to behavioral inaccuracies observed in memory recall. However, many bump attractor models collapse these subpopulations into a single joint excitatory/inhibitory (lateral inhibitory) population, and do not consider the role of interpopulation neural architecture and noise correlations. Both factors have a high potential to impinge upon the stochastic dynamics of these bumps, ultimately shaping behavioral response variance. In our study, we consider a neural field model with separate excitatory/inhibitory (E/I) populations and leverage asymptotic analysis to derive a nonlinear Langevin system describing E/I bump interactions. While the E bump attracts the I bump, the I bump stabilizes but can also repel the E bump, which can result in prolonged relaxation dynamics when both bumps are perturbed. Furthermore, the structure of noise correlations within and between subpopulations strongly shapes the variance in bump position. Surprisingly, higher interpopulation correlations reduce variance.
1907.00973
Ivan Ezhov
Ivan Ezhov, Jana Lipkova, Suprosanna Shit, Florian Kofler, Nore Collomb, Benjamin Lemasson, Emmanuel Barbier, Bjoern Menze
Neural parameters estimation for brain tumor growth modeling
null
null
10.1007/978-3-030-32245-8_87
null
q-bio.QM cs.LG eess.IV stat.ML
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
Understanding the dynamics of brain tumor progression is essential for optimal treatment planning. Cast in a mathematical formulation, it is typically viewed as evaluation of a system of partial differential equations, wherein the physiological processes that govern the growth of the tumor are considered. To personalize the model, i.e. find a relevant set of parameters, with respect to the tumor dynamics of a particular patient, the model is informed from empirical data, e.g., medical images obtained from diagnostic modalities, such as magnetic-resonance imaging. Existing model-observation coupling schemes require a large number of forward integrations of the biophysical model and rely on simplifying assumption on the functional form, linking the output of the model with the image information. In this work, we propose a learning-based technique for the estimation of tumor growth model parameters from medical scans. The technique allows for explicit evaluation of the posterior distribution of the parameters by sequentially training a mixture-density network, relaxing the constraint on the functional form and reducing the number of samples necessary to propagate through the forward model for the estimation. We test the method on synthetic and real scans of rats injected with brain tumors to calibrate the model and to predict tumor progression.
[ { "created": "Mon, 1 Jul 2019 17:57:14 GMT", "version": "v1" }, { "created": "Thu, 9 Jan 2020 19:04:45 GMT", "version": "v2" } ]
2020-01-13
[ [ "Ezhov", "Ivan", "" ], [ "Lipkova", "Jana", "" ], [ "Shit", "Suprosanna", "" ], [ "Kofler", "Florian", "" ], [ "Collomb", "Nore", "" ], [ "Lemasson", "Benjamin", "" ], [ "Barbier", "Emmanuel", "" ], [ ...
Understanding the dynamics of brain tumor progression is essential for optimal treatment planning. Cast in a mathematical formulation, it is typically viewed as evaluation of a system of partial differential equations, wherein the physiological processes that govern the growth of the tumor are considered. To personalize the model, i.e. find a relevant set of parameters, with respect to the tumor dynamics of a particular patient, the model is informed from empirical data, e.g., medical images obtained from diagnostic modalities, such as magnetic-resonance imaging. Existing model-observation coupling schemes require a large number of forward integrations of the biophysical model and rely on simplifying assumption on the functional form, linking the output of the model with the image information. In this work, we propose a learning-based technique for the estimation of tumor growth model parameters from medical scans. The technique allows for explicit evaluation of the posterior distribution of the parameters by sequentially training a mixture-density network, relaxing the constraint on the functional form and reducing the number of samples necessary to propagate through the forward model for the estimation. We test the method on synthetic and real scans of rats injected with brain tumors to calibrate the model and to predict tumor progression.
2102.04896
Dalton Sakthivadivel
Dalton A R Sakthivadivel
Formalising the Use of the Activation Function in Neural Inference
14+2 pages, two figures. TikZ code included in submission
Complex Systems, 31(4), 2022
10.25088/ComplexSystems.31.4.433
null
q-bio.NC cond-mat.dis-nn cond-mat.stat-mech stat.ML
http://creativecommons.org/licenses/by-nc-sa/4.0/
We investigate how the activation function can be used to describe neural firing in an abstract way, and in turn, why it works well in artificial neural networks. We discuss how a spike in a biological neurone belongs to a particular universality class of phase transitions in statistical physics. We then show that the artificial neurone is, mathematically, a mean field model of biological neural membrane dynamics, which arises from modelling spiking as a phase transition. This allows us to treat selective neural firing in an abstract way, and formalise the role of the activation function in perceptron learning. The resultant statistical physical model allows us to recover the expressions for some known activation functions as various special cases. Along with deriving this model and specifying the analogous neural case, we analyse the phase transition to understand the physics of neural network learning. Together, it is shown that there is not only a biological meaning, but a physical justification, for the emergence and performance of typical activation functions; implications for neural learning and inference are also discussed.
[ { "created": "Tue, 2 Feb 2021 19:42:21 GMT", "version": "v1" }, { "created": "Tue, 27 Jul 2021 16:55:31 GMT", "version": "v2" }, { "created": "Sun, 25 Dec 2022 04:16:51 GMT", "version": "v3" } ]
2022-12-27
[ [ "Sakthivadivel", "Dalton A R", "" ] ]
We investigate how the activation function can be used to describe neural firing in an abstract way, and in turn, why it works well in artificial neural networks. We discuss how a spike in a biological neurone belongs to a particular universality class of phase transitions in statistical physics. We then show that the artificial neurone is, mathematically, a mean field model of biological neural membrane dynamics, which arises from modelling spiking as a phase transition. This allows us to treat selective neural firing in an abstract way, and formalise the role of the activation function in perceptron learning. The resultant statistical physical model allows us to recover the expressions for some known activation functions as various special cases. Along with deriving this model and specifying the analogous neural case, we analyse the phase transition to understand the physics of neural network learning. Together, it is shown that there is not only a biological meaning, but a physical justification, for the emergence and performance of typical activation functions; implications for neural learning and inference are also discussed.
q-bio/0403013
Dmitry Tsigankov
Dmitry N. Tsigankov and Alexei A. Koulakov
Can repulsion be induced by attraction: a role of ephrin-B1 in retinotectal mapping?
4 pages
null
null
null
q-bio.NC q-bio.QM
null
We study a role of EphB receptors and their ligand ephrin-B1 in dorsal-ventral retinotopic mapping. Earlier studies suggested that ephrin-B1 acts as an attractant for EphB expressing axons. We address the results of the recent experiment in chick tectum (McLaughlin et al., 2003b) in which axons of retinal ganglion cells were shown to be repelled by high ephrin-B1 density. Thus it was proposed that ephrin-B1 might act as both attractant and repellent. We show that the same axonal behavior may follow from attraction to ephrin-B1 density and axonal competition for space. Therefore, we show how apparent repulsive interaction can be induced by a combination of attraction to the target and competitive interactions between axons. We suggest an experimental test that may distinguish repulsive interaction with the target from repulsion induced by attraction and competition.
[ { "created": "Thu, 11 Mar 2004 17:10:04 GMT", "version": "v1" } ]
2007-05-23
[ [ "Tsigankov", "Dmitry N.", "" ], [ "Koulakov", "Alexei A.", "" ] ]
We study a role of EphB receptors and their ligand ephrin-B1 in dorsal-ventral retinotopic mapping. Earlier studies suggested that ephrin-B1 acts as an attractant for EphB expressing axons. We address the results of the recent experiment in chick tectum (McLaughlin et al., 2003b) in which axons of retinal ganglion cells were shown to be repelled by high ephrin-B1 density. Thus it was proposed that ephrin-B1 might act as both attractant and repellent. We show that the same axonal behavior may follow from attraction to ephrin-B1 density and axonal competition for space. Therefore, we show how apparent repulsive interaction can be induced by a combination of attraction to the target and competitive interactions between axons. We suggest an experimental test that may distinguish repulsive interaction with the target from repulsion induced by attraction and competition.
0810.1752
Christopher Frenz
Gregory Martyn, Christopher M. Frenz
ESPSim: A JAVA Application for Calculating Electrostatic Potential Map Similarity Scores
Published in the Proceedings of the 2008 International Conference on Bioinformatics and Computational Biology (BIOCOMP 2008). Pages 735-737
null
null
null
q-bio.BM
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
ESPSim is an open source JAVA program that enables the comparisons of protein electrostatic potential maps via the computation of an electrostatic similarity measure. This program has been utilized to demonstrate a high degree of electrostatic similarity among the potential maps of lysozyme proteins, suggesting that protein electrostatic states are conserved within lysozyme proteins. ESPSim is freely available under the AGPL License from http://www.bioinformatics.org/project/?group_id=830
[ { "created": "Thu, 9 Oct 2008 20:40:59 GMT", "version": "v1" } ]
2008-10-13
[ [ "Martyn", "Gregory", "" ], [ "Frenz", "Christopher M.", "" ] ]
ESPSim is an open source JAVA program that enables the comparisons of protein electrostatic potential maps via the computation of an electrostatic similarity measure. This program has been utilized to demonstrate a high degree of electrostatic similarity among the potential maps of lysozyme proteins, suggesting that protein electrostatic states are conserved within lysozyme proteins. ESPSim is freely available under the AGPL License from http://www.bioinformatics.org/project/?group_id=830
2006.16955
Stanislaw Jastrzebski
Tobiasz Cieplinski, Tomasz Danel, Sabina Podlewska, Stanislaw Jastrzebski
We Should at Least Be Able to Design Molecules That Dock Well
Published in Journal of Chemical Information and Modeling
null
10.1021/acs.jcim.2c01355
null
q-bio.BM cs.LG stat.ML
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
Designing compounds with desired properties is a key element of the drug discovery process. However, measuring progress in the field has been challenging due to the lack of realistic retrospective benchmarks, and the large cost of prospective validation. To close this gap, we propose a benchmark based on docking, a popular computational method for assessing molecule binding to a protein. Concretely, the goal is to generate drug-like molecules that are scored highly by SMINA, a popular docking software. We observe that popular graph-based generative models fail to generate molecules with a high docking score when trained using a realistically sized training set. This suggests a limitation of the current incarnation of models for de novo drug design. Finally, we propose a simplified version of the benchmark based on a simpler scoring function, and show that the tested models are able to partially solve it. We release the benchmark as an easy to use package available at https://github.com/cieplinski-tobiasz/smina-docking-benchmark. We hope that our benchmark will serve as a stepping stone towards the goal of automatically generating promising drug candidates.
[ { "created": "Sat, 20 Jun 2020 16:40:56 GMT", "version": "v1" }, { "created": "Wed, 1 Jul 2020 00:30:07 GMT", "version": "v2" }, { "created": "Mon, 28 Dec 2020 08:10:50 GMT", "version": "v3" }, { "created": "Mon, 28 Jun 2021 08:21:45 GMT", "version": "v4" }, { "cr...
2023-06-16
[ [ "Cieplinski", "Tobiasz", "" ], [ "Danel", "Tomasz", "" ], [ "Podlewska", "Sabina", "" ], [ "Jastrzebski", "Stanislaw", "" ] ]
Designing compounds with desired properties is a key element of the drug discovery process. However, measuring progress in the field has been challenging due to the lack of realistic retrospective benchmarks, and the large cost of prospective validation. To close this gap, we propose a benchmark based on docking, a popular computational method for assessing molecule binding to a protein. Concretely, the goal is to generate drug-like molecules that are scored highly by SMINA, a popular docking software. We observe that popular graph-based generative models fail to generate molecules with a high docking score when trained using a realistically sized training set. This suggests a limitation of the current incarnation of models for de novo drug design. Finally, we propose a simplified version of the benchmark based on a simpler scoring function, and show that the tested models are able to partially solve it. We release the benchmark as an easy to use package available at https://github.com/cieplinski-tobiasz/smina-docking-benchmark. We hope that our benchmark will serve as a stepping stone towards the goal of automatically generating promising drug candidates.
1710.05067
Thierry Mora
Christophe Gardella, Olivier Marre, Thierry Mora
Blindfold learning of an accurate neural metric
null
Proc Natl Acad Sci USA (2018)
10.1073/pnas.1718710115
null
q-bio.NC
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
The brain has no direct access to physical stimuli, but only to the spiking activity evoked in sensory organs. It is unclear how the brain can structure its representation of the world based on differences between those noisy, correlated responses alone. Here we show how to build a distance map of responses from the structure of the population activity of retinal ganglion cells, allowing for the accurate discrimination of distinct visual stimuli from the retinal response. We introduce the Temporal Restricted Boltzmann Machine to learn the spatiotemporal structure of the population activity, and use this model to define a distance between spike trains. We show that this metric outperforms existing neural distances at discriminating pairs of stimuli that are barely distinguishable. The proposed method provides a generic and biologically plausible way to learn to associate similar stimuli based on their spiking responses, without any other knowledge of these stimuli.
[ { "created": "Fri, 13 Oct 2017 20:08:43 GMT", "version": "v1" } ]
2018-04-16
[ [ "Gardella", "Christophe", "" ], [ "Marre", "Olivier", "" ], [ "Mora", "Thierry", "" ] ]
The brain has no direct access to physical stimuli, but only to the spiking activity evoked in sensory organs. It is unclear how the brain can structure its representation of the world based on differences between those noisy, correlated responses alone. Here we show how to build a distance map of responses from the structure of the population activity of retinal ganglion cells, allowing for the accurate discrimination of distinct visual stimuli from the retinal response. We introduce the Temporal Restricted Boltzmann Machine to learn the spatiotemporal structure of the population activity, and use this model to define a distance between spike trains. We show that this metric outperforms existing neural distances at discriminating pairs of stimuli that are barely distinguishable. The proposed method provides a generic and biologically plausible way to learn to associate similar stimuli based on their spiking responses, without any other knowledge of these stimuli.
0910.1418
Angelo Troina
Mario Coppo (Dipartimento di Informatica, Universit\'a di Torino), Ferruccio Damiani (Dipartimento di Informatica, Universit\'a di Torino), Elena Grassi (Molecular Biotechnology Center, Dipartimento di Genetica, Biologia e Biochimica and Dipartimento di Informatica, Universit\'a di Torino), Mike Guether (Dipartimento di Biologia Vegetale, Universit\`a di Torino), Angelo Troina (Dipartimento di Informatica, Universit\'a di Torino)
Modelling an Ammonium Transporter with SCLS
null
EPTCS 6, 2009, pp. 77-92
10.4204/EPTCS.6.6
null
q-bio.QM cs.CE q-bio.CB
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
The Stochastic Calculus of Looping Sequences (SCLS) is a recently proposed modelling language for the representation and simulation of biological systems behaviour. It has been designed with the aim of combining the simplicity of notation of rewrite systems with the advantage of compositionality. It also allows a rather simple and accurate description of biological membranes and their interactions with the environment. In this work we apply SCLS to model a newly discovered ammonium transporter. This transporter is believed to play a fundamental role for plant mineral acquisition, which takes place in the arbuscular mycorrhiza, the most wide-spread plant-fungus symbiosis on earth. Due to its potential application in agriculture this kind of symbiosis is one of the main focuses of the BioBITs project. In our experiments the passage of NH3 / NH4+ from the fungus to the plant has been dissected in known and hypothetical mechanisms; with the model so far we have been able to simulate the behaviour of the system under different conditions. Our simulations confirmed some of the latest experimental results about the LjAMT2;2 transporter. The initial simulation results of the modelling of the symbiosis process are promising and indicate new directions for biological investigations.
[ { "created": "Thu, 8 Oct 2009 19:48:20 GMT", "version": "v1" }, { "created": "Fri, 14 May 2010 11:30:46 GMT", "version": "v2" } ]
2015-03-13
[ [ "Coppo", "Mario", "", "Dipartimento di Informatica, Universitá di Torino" ], [ "Damiani", "Ferruccio", "", "Dipartimento di Informatica, Universitá di Torino" ], [ "Grassi", "Elena", "", "Molecular Biotechnology Center, Dipartimento di Genetica,\n Biologia ...
The Stochastic Calculus of Looping Sequences (SCLS) is a recently proposed modelling language for the representation and simulation of biological systems behaviour. It has been designed with the aim of combining the simplicity of notation of rewrite systems with the advantage of compositionality. It also allows a rather simple and accurate description of biological membranes and their interactions with the environment. In this work we apply SCLS to model a newly discovered ammonium transporter. This transporter is believed to play a fundamental role for plant mineral acquisition, which takes place in the arbuscular mycorrhiza, the most wide-spread plant-fungus symbiosis on earth. Due to its potential application in agriculture this kind of symbiosis is one of the main focuses of the BioBITs project. In our experiments the passage of NH3 / NH4+ from the fungus to the plant has been dissected in known and hypothetical mechanisms; with the model so far we have been able to simulate the behaviour of the system under different conditions. Our simulations confirmed some of the latest experimental results about the LjAMT2;2 transporter. The initial simulation results of the modelling of the symbiosis process are promising and indicate new directions for biological investigations.
1304.0342
Dixita Limbachiya PhD candidate
Dixita Limbachiya
Synthetic Biology in Leishmaniasis: Design,simulation and validation of constructed Genetic circuit
This is Master of Science thesis from Sardar Patel university. Part of the thesis has been published as the following paper: "Mandlik, Vineetha, Dixita Limbachiya, Sonali Shinde, Milsee Mol, and Shailza Singh. "Synthetic circuit of inositol phosphorylceramide synthase in Leishmania: a chemical biology approach." Journal of Chemical Biology (2012): 1-12" in the Journal of Chemical Biology
null
null
null
q-bio.MN
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
Building circuits and studying their behavior in cells is a major goal of systems and synthetic biology. Synthetic biology enables the precise control of cellular states for systems studies, the discovery of novel parts, control strategies, and interactions for the design of robust synthetic systems. To the best of our knowledge,there are no literature reports for the synthetic circuit construction for protozoan parasites. This paper describes the construction of genetic circuit for the targeted enzyme inositol phosphorylceramide synthase belonging to the protozoan parasite Leishmania. To explore the dynamic nature of the circuit designed, simulation was done followed by circuit validation by qualitative and quantitative approaches. The genetic circuit designed for inositol phosphorylceramide synthase shows responsiveness, oscillatory and bistable behavior, together with intrinsic robustness.
[ { "created": "Mon, 1 Apr 2013 12:32:52 GMT", "version": "v1" } ]
2013-04-02
[ [ "Limbachiya", "Dixita", "" ] ]
Building circuits and studying their behavior in cells is a major goal of systems and synthetic biology. Synthetic biology enables the precise control of cellular states for systems studies, the discovery of novel parts, control strategies, and interactions for the design of robust synthetic systems. To the best of our knowledge,there are no literature reports for the synthetic circuit construction for protozoan parasites. This paper describes the construction of genetic circuit for the targeted enzyme inositol phosphorylceramide synthase belonging to the protozoan parasite Leishmania. To explore the dynamic nature of the circuit designed, simulation was done followed by circuit validation by qualitative and quantitative approaches. The genetic circuit designed for inositol phosphorylceramide synthase shows responsiveness, oscillatory and bistable behavior, together with intrinsic robustness.
0806.4449
Renaud Jolivet
Renaud Jolivet, Michel Antoniazza, Catherine Strehler-Perrin and Antoine Gander
Impact of road mitigation measures on amphibian populations: A stage-class population mathematical model
18 pages, 3 figures, 2 tables and 4 supplementary figures
null
null
null
q-bio.PE
http://creativecommons.org/licenses/by-nc-sa/3.0/
It is now well established that amphibians are suffering widespread decline and extinctions. Among other causes, urbanization is responsible for habitat reduction, habitat fragmentation and massive road kills. In this context, it is urgent to develop and assess appropriate conservation measures. Using yearly censuses of migrating adults of two anuran species at one location in Switzerland, we examined the impact of a road mitigation measure - permanent under-road tunnels with guiding trenches - along a road separating wintering forests from breeding wetlands. We observe that the adult migrating populations do not exhibit any long-term trend but undergo a transient increase a few years after the installation of the road mitigation measure. Using additional datasets like climatic data and censuses obtained in a control area, we show that the observed pattern of migrating populations cannot be explained by any other data at our disposal. We then checked as a working hypothesis whether the installation of under-road tunnels could explain the observed transient or not. To this end, we use a simple population model and show that the road mitigation measure together with competition for resources can successfully explain the experimental observations. We conclude by discussing the requirements for further assessment of this hypothesis as well as consequences for conservation planners.
[ { "created": "Fri, 27 Jun 2008 08:15:59 GMT", "version": "v1" } ]
2009-09-29
[ [ "Jolivet", "Renaud", "" ], [ "Antoniazza", "Michel", "" ], [ "Strehler-Perrin", "Catherine", "" ], [ "Gander", "Antoine", "" ] ]
It is now well established that amphibians are suffering widespread decline and extinctions. Among other causes, urbanization is responsible for habitat reduction, habitat fragmentation and massive road kills. In this context, it is urgent to develop and assess appropriate conservation measures. Using yearly censuses of migrating adults of two anuran species at one location in Switzerland, we examined the impact of a road mitigation measure - permanent under-road tunnels with guiding trenches - along a road separating wintering forests from breeding wetlands. We observe that the adult migrating populations do not exhibit any long-term trend but undergo a transient increase a few years after the installation of the road mitigation measure. Using additional datasets like climatic data and censuses obtained in a control area, we show that the observed pattern of migrating populations cannot be explained by any other data at our disposal. We then checked as a working hypothesis whether the installation of under-road tunnels could explain the observed transient or not. To this end, we use a simple population model and show that the road mitigation measure together with competition for resources can successfully explain the experimental observations. We conclude by discussing the requirements for further assessment of this hypothesis as well as consequences for conservation planners.
1811.04489
Milena \v{C}uki\'c Dr
\v{C}uki\'c Milena, Stoki\'c Miodrag, Radenkovi\'c Slavoljub, Ljubisavljevi\'c Milo\v{s}, Simi\'c Slobodan, Danka Savi\'c
Nonlinear analysis of EEG complexity in episode and remission phase of recurrent depression
23 pages, 6 figures
09 December 2019. IJMPR https://onlinelibrary.wiley.com/doi/full/10.1002/mpr.1816
10.1002/MPR.1816
null
q-bio.NC
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
Biomarkers of Major Depressive Disorder(MDD), its phases and forms have long been sought. Research indicates that the complexity measures of the cortical electrical activity (EEG) might be candidates for this role. To examine whether the complexity of EEG activity, measured by Higuchi fractal dimension (HFD) and sample entropy (SampEn), differs between healthy subjects, patients in remission and episode phase of the recurrent depression and whether the changes are differentially distributed between hemispheres and cortical regions. Resting state EEG with eyes closed was recorded from 26 patients suffering from recurrent depression and 20 age and sex-matched healthy control subjects. Artefact-free EEG epochs were analyzed by in-house developed programs running HFD and SampEn algorithms. Depressed patients had higher HFD and SampEn complexity compared to healthy subjects. Surprisingly, the complexity was even higher in patients who were in remission than in those in the episode. Altered complexity was present in the frontal and centro-parietal regions when compared to the control group. The complexity in frontal and parietal regions differed between the two phases of depressive disorder. SampEn manifested higher sensitivity than HFD in some cortical areas. Complexity measures of EEG distinguish between the three groups. Further studies are needed to establish whether these measures carry the potential to aid clinically relevant decisions about depression.
[ { "created": "Sun, 11 Nov 2018 21:55:23 GMT", "version": "v1" } ]
2019-12-19
[ [ "Milena", "Čukić", "" ], [ "Miodrag", "Stokić", "" ], [ "Slavoljub", "Radenković", "" ], [ "Miloš", "Ljubisavljević", "" ], [ "Slobodan", "Simić", "" ], [ "Savić", "Danka", "" ] ]
Biomarkers of Major Depressive Disorder(MDD), its phases and forms have long been sought. Research indicates that the complexity measures of the cortical electrical activity (EEG) might be candidates for this role. To examine whether the complexity of EEG activity, measured by Higuchi fractal dimension (HFD) and sample entropy (SampEn), differs between healthy subjects, patients in remission and episode phase of the recurrent depression and whether the changes are differentially distributed between hemispheres and cortical regions. Resting state EEG with eyes closed was recorded from 26 patients suffering from recurrent depression and 20 age and sex-matched healthy control subjects. Artefact-free EEG epochs were analyzed by in-house developed programs running HFD and SampEn algorithms. Depressed patients had higher HFD and SampEn complexity compared to healthy subjects. Surprisingly, the complexity was even higher in patients who were in remission than in those in the episode. Altered complexity was present in the frontal and centro-parietal regions when compared to the control group. The complexity in frontal and parietal regions differed between the two phases of depressive disorder. SampEn manifested higher sensitivity than HFD in some cortical areas. Complexity measures of EEG distinguish between the three groups. Further studies are needed to establish whether these measures carry the potential to aid clinically relevant decisions about depression.
1012.3679
Jose A Capitan
Jose A. Cuesta, Jacobo Aguirre, Jose A. Capitan and Susanna C. Manrubia
The struggle for space: Viral extinction through competition for cells
4 pages, 3 figures Accepted for publication in Physical Review Letters
Physical Review Letters 106, 028104 (2011)
10.1103/PhysRevLett.106.028104
null
q-bio.PE
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
The design of protocols to suppress the propagation of viral infections is an enduring enterprise, especially hindered by limited knowledge of the mechanisms through which extinction of infection propagation comes about. We here report on a mechanism causing extinction of a propagating infection due to intraspecific competition to infect susceptible hosts. Beneficial mutations allow the pathogen to increase the production of progeny, while the host cell is allowed to develop defenses against infection. When the number of susceptible cells is unlimited, a feedback runaway co-evolution between host resistance and progeny production occurs. However, physical space limits the advantage that the virus can obtain from increasing offspring numbers, thus infection clearance may result from an increase in host defenses beyond a finite threshold. Our results might be relevant to better understand propagation of viral infections in tissues with mobility constraints, and the implications that environments with different geometrical properties might have in devising control strategies.
[ { "created": "Thu, 16 Dec 2010 17:09:42 GMT", "version": "v1" } ]
2015-02-18
[ [ "Cuesta", "Jose A.", "" ], [ "Aguirre", "Jacobo", "" ], [ "Capitan", "Jose A.", "" ], [ "Manrubia", "Susanna C.", "" ] ]
The design of protocols to suppress the propagation of viral infections is an enduring enterprise, especially hindered by limited knowledge of the mechanisms through which extinction of infection propagation comes about. We here report on a mechanism causing extinction of a propagating infection due to intraspecific competition to infect susceptible hosts. Beneficial mutations allow the pathogen to increase the production of progeny, while the host cell is allowed to develop defenses against infection. When the number of susceptible cells is unlimited, a feedback runaway co-evolution between host resistance and progeny production occurs. However, physical space limits the advantage that the virus can obtain from increasing offspring numbers, thus infection clearance may result from an increase in host defenses beyond a finite threshold. Our results might be relevant to better understand propagation of viral infections in tissues with mobility constraints, and the implications that environments with different geometrical properties might have in devising control strategies.
1708.06305
Adam Noel
Adam Noel, Yuting Fang, Nan Yang, Dimitrios Makrakis, Andrew W. Eckford
Effect of Local Population Uncertainty on Cooperation in Bacteria
5 pages, 6 figures. Will be presented as an invited paper at the 2017 IEEE Information Theory Workshop in November 2017 in Kaohsiung, Taiwan
null
10.1109/ITW.2017.8278046
null
q-bio.CB physics.bio-ph q-bio.PE
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
Bacteria populations rely on mechanisms such as quorum sensing to coordinate complex tasks that cannot be achieved by a single bacterium. Quorum sensing is used to measure the local bacteria population density, and it controls cooperation by ensuring that a bacterium only commits the resources for cooperation when it expects its neighbors to reciprocate. This paper proposes a simple model for sharing a resource in a bacterial environment, where knowledge of the population influences each bacterium's behavior. Game theory is used to model the behavioral dynamics, where the net payoff (i.e., utility) for each bacterium is a function of its current behavior and that of the other bacteria. The game is first evaluated with perfect knowledge of the population. Then, the unreliability of diffusion introduces uncertainty in the local population estimate and changes the perceived payoffs. The results demonstrate the sensitivity to the system parameters and how population uncertainty can overcome a lack of explicit coordination.
[ { "created": "Mon, 21 Aug 2017 16:05:55 GMT", "version": "v1" } ]
2018-02-14
[ [ "Noel", "Adam", "" ], [ "Fang", "Yuting", "" ], [ "Yang", "Nan", "" ], [ "Makrakis", "Dimitrios", "" ], [ "Eckford", "Andrew W.", "" ] ]
Bacteria populations rely on mechanisms such as quorum sensing to coordinate complex tasks that cannot be achieved by a single bacterium. Quorum sensing is used to measure the local bacteria population density, and it controls cooperation by ensuring that a bacterium only commits the resources for cooperation when it expects its neighbors to reciprocate. This paper proposes a simple model for sharing a resource in a bacterial environment, where knowledge of the population influences each bacterium's behavior. Game theory is used to model the behavioral dynamics, where the net payoff (i.e., utility) for each bacterium is a function of its current behavior and that of the other bacteria. The game is first evaluated with perfect knowledge of the population. Then, the unreliability of diffusion introduces uncertainty in the local population estimate and changes the perceived payoffs. The results demonstrate the sensitivity to the system parameters and how population uncertainty can overcome a lack of explicit coordination.
1805.03527
Chengyi Tu
Chengyi Tu, Samir Suweis, Jacopo Grillib, Marco Formentin, Amos Maritan
Reconciling cooperation, biodiversity and stability in complex ecological communities
Incorrectdly posted twice. Current version arXiv:1708.03154
null
null
null
q-bio.PE physics.bio-ph
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
Empirical observations show that ecological communities can have a huge number of coexisting species, also with few or limited number of resources. These ecosystems are characterized by multiple type of interactions, in particular displaying cooperative behaviors. However, standard modeling of population dynamics based on Lotka-Volterra type of equations predicts that ecosystem stability should decrease as the number of species in the community increases and that cooperative systems are less stable than communities with only competitive and/or exploitative interactions. Here we propose a stochastic model of population dynamics, which includes exploitative interactions as well as cooperative interactions induced by cross-feeding. The model is exactly solved and we obtain results for relevant macro-ecological patterns, such as species abundance distributions and correlation functions. In the large system size limit, any number of species can coexist for a very general class of interaction networks and stability increases as the number of species grows. For pure mutualistic/commensalistic interactions we determine the topological properties of the network that guarantee species coexistence. We also show that the stationary state is globally stable and that inferring species interactions through species abundance correlation analysis may be misleading. Our theoretical approach thus show that appropriate models of cooperation naturally leads to a solution of the long-standing question about complexity-stability paradox and on how highly biodiverse communities can coexist.
[ { "created": "Tue, 8 May 2018 07:50:21 GMT", "version": "v1" }, { "created": "Wed, 16 May 2018 18:08:38 GMT", "version": "v2" } ]
2018-05-18
[ [ "Tu", "Chengyi", "" ], [ "Suweis", "Samir", "" ], [ "Grillib", "Jacopo", "" ], [ "Formentin", "Marco", "" ], [ "Maritan", "Amos", "" ] ]
Empirical observations show that ecological communities can have a huge number of coexisting species, also with few or limited number of resources. These ecosystems are characterized by multiple type of interactions, in particular displaying cooperative behaviors. However, standard modeling of population dynamics based on Lotka-Volterra type of equations predicts that ecosystem stability should decrease as the number of species in the community increases and that cooperative systems are less stable than communities with only competitive and/or exploitative interactions. Here we propose a stochastic model of population dynamics, which includes exploitative interactions as well as cooperative interactions induced by cross-feeding. The model is exactly solved and we obtain results for relevant macro-ecological patterns, such as species abundance distributions and correlation functions. In the large system size limit, any number of species can coexist for a very general class of interaction networks and stability increases as the number of species grows. For pure mutualistic/commensalistic interactions we determine the topological properties of the network that guarantee species coexistence. We also show that the stationary state is globally stable and that inferring species interactions through species abundance correlation analysis may be misleading. Our theoretical approach thus show that appropriate models of cooperation naturally leads to a solution of the long-standing question about complexity-stability paradox and on how highly biodiverse communities can coexist.
2202.03132
Hirokuni Miyamoto
Hirokuni Miyamoto, Katsumi Shigeta, Wataru Suda, Yasunori Ichihashi, Naoto Nihei, Makiko Matsuura, Arisa Tsuboi, Naoki Tominaga, Masahiko Aono, Muneo Sato, Shunya Taguchi, Teruno Nakaguma, Naoko Tsuji, Chitose Ishii, Teruo Matsushita, Chie Shindo, Toshiaki Ito, Tamotsu Kato, Hiroshi Ohno, Atsushi Kurotani, Hideaki Shima, Shigeharu Moriya, Sankichi Horiuchi, Takashi Satoh, Kenichi Mori, Takumi Nishiuchi, Hisashi Miyamoto, Masahira Hattori, Hiroaki Kodama, Jun Kikuchi, Yumi Hirai
Agricultural quality matrix-based multiomics structural analysis of carrots in soils fertilized with thermophile-fermented compost
6 figures, 1 Table, and support information
null
10.1038/s43705-023-00233-9
null
q-bio.QM
http://creativecommons.org/licenses/by/4.0/
Compost is used worldwide as a soil conditioner for crops, but its functions have still been explored. Here, the omics profiles of carrots were investigated, as a root vegetable plant model, in a field amended with compost fermented with thermophilic Bacillaceae for growth and quality indices. Exposure to compost significantly increased the productivity, antioxidant activity, red color, and taste of the carrot root and altered the soil bacterial composition with the levels of characteristic metabolites of the leaf, root, and soil. Based on the data, structural equation modeling (SEM) estimated that L-2-aminoadipate, phenylalanine, flavonoids and / or carotenoids in plants were optimally linked by exposure to compost. The SEM of the soil estimated that the genus Paenibacillus, L-2-aminoadipate and nicotinamide, and S-methyl L-cysteine were optimally involved during exposure. These estimates did not show a contradiction between the whole genomic analysis of compost-derived Paenibacillus isolates and the bioactivity data, inferring the presence of a complex cascade of plant growth-promoting effects and modulation of the nitrogen cycle by compost itself. These observations have provided information on the qualitative indicators of compost in complex soil-plant interactions and offer a new perspective for chemically independent sustainable agriculture through the efficient use of natural nitrogen.
[ { "created": "Mon, 7 Feb 2022 13:18:25 GMT", "version": "v1" }, { "created": "Sun, 27 Feb 2022 03:07:20 GMT", "version": "v2" }, { "created": "Mon, 14 Mar 2022 01:55:29 GMT", "version": "v3" }, { "created": "Sat, 15 Oct 2022 22:51:31 GMT", "version": "v4" }, { "cr...
2023-04-24
[ [ "Miyamoto", "Hirokuni", "" ], [ "Shigeta", "Katsumi", "" ], [ "Suda", "Wataru", "" ], [ "Ichihashi", "Yasunori", "" ], [ "Nihei", "Naoto", "" ], [ "Matsuura", "Makiko", "" ], [ "Tsuboi", "Arisa", "" ], ...
Compost is used worldwide as a soil conditioner for crops, but its functions have still been explored. Here, the omics profiles of carrots were investigated, as a root vegetable plant model, in a field amended with compost fermented with thermophilic Bacillaceae for growth and quality indices. Exposure to compost significantly increased the productivity, antioxidant activity, red color, and taste of the carrot root and altered the soil bacterial composition with the levels of characteristic metabolites of the leaf, root, and soil. Based on the data, structural equation modeling (SEM) estimated that L-2-aminoadipate, phenylalanine, flavonoids and / or carotenoids in plants were optimally linked by exposure to compost. The SEM of the soil estimated that the genus Paenibacillus, L-2-aminoadipate and nicotinamide, and S-methyl L-cysteine were optimally involved during exposure. These estimates did not show a contradiction between the whole genomic analysis of compost-derived Paenibacillus isolates and the bioactivity data, inferring the presence of a complex cascade of plant growth-promoting effects and modulation of the nitrogen cycle by compost itself. These observations have provided information on the qualitative indicators of compost in complex soil-plant interactions and offer a new perspective for chemically independent sustainable agriculture through the efficient use of natural nitrogen.
2312.04607
Lea Schuh
Lea Schuh, Peter V. Markov, Vladimir M. Veliov, Nikolaos I. Stilianakis
A mathematical model for the within-host (re)infection dynamics of SARS-CoV-2
18 pages, 6 figures
null
null
null
q-bio.QM physics.soc-ph
http://creativecommons.org/licenses/by/4.0/
Interactions between SARS-CoV-2 and the immune system during infection are complex. However, understanding the within-host SARS-CoV-2 dynamics is of enormous importance, especially when it comes to assessing treatment options. Mathematical models have been developed to describe the within-host SARS-CoV-2 dynamics and to dissect the mechanisms underlying COVID-19 pathogenesis. Current mathematical models focus on the acute infection phase, thereby ignoring important post-acute infection effects. We present a mathematical model, which not only describes the SARS-CoV-2 infection dynamics during the acute infection phase, but also reflects the recovery of the number of susceptible epithelial cells to an initial pre-infection homeostatic level, shows clearance of the infection within the individual, immune waning, and the formation of long-term immune response levels after infection. Moreover, the model accommodates reinfection events assuming a new virus variant with either increased infectivity or immune escape. Together, the model provides an improved reflection of the SARS-CoV-2 infection dynamics within humans, particularly important when using mathematical models to develop or optimize treatment options.
[ { "created": "Thu, 7 Dec 2023 12:18:58 GMT", "version": "v1" } ]
2023-12-11
[ [ "Schuh", "Lea", "" ], [ "Markov", "Peter V.", "" ], [ "Veliov", "Vladimir M.", "" ], [ "Stilianakis", "Nikolaos I.", "" ] ]
Interactions between SARS-CoV-2 and the immune system during infection are complex. However, understanding the within-host SARS-CoV-2 dynamics is of enormous importance, especially when it comes to assessing treatment options. Mathematical models have been developed to describe the within-host SARS-CoV-2 dynamics and to dissect the mechanisms underlying COVID-19 pathogenesis. Current mathematical models focus on the acute infection phase, thereby ignoring important post-acute infection effects. We present a mathematical model, which not only describes the SARS-CoV-2 infection dynamics during the acute infection phase, but also reflects the recovery of the number of susceptible epithelial cells to an initial pre-infection homeostatic level, shows clearance of the infection within the individual, immune waning, and the formation of long-term immune response levels after infection. Moreover, the model accommodates reinfection events assuming a new virus variant with either increased infectivity or immune escape. Together, the model provides an improved reflection of the SARS-CoV-2 infection dynamics within humans, particularly important when using mathematical models to develop or optimize treatment options.
1807.05740
Ivan Lazarevich
Ivan Lazarevich and Sergey Stasenko and Maia Rozhnova and Evgeniya Pankratova and Alexander Dityatev and Victor Kazantsev
Dynamics of the brain extracellular matrix governed by interactions with neural cells
null
null
null
null
q-bio.NC q-bio.CB
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
Neuronal and glial cells release diverse proteoglycans and glycoproteins, which aggregate in the extracellular space and form the extracellular matrix (ECM) that may in turn regulate major cellular functions. Brain cells also release extracellular proteases that may degrade the ECM, and both synthesis and degradation of ECM are activity-dependent. In this study we introduce a mathematical model describing population dynamics of neurons interacting with ECM molecules over extended timescales. It is demonstrated that depending on the prevalent biophysical mechanism of ECM-neuronal interactions, different dynamical regimes of ECM activity can be observed, including bistable states with stable stationary levels of ECM molecule concentration, spontaneous ECM oscillations, and coexistence of ECM oscillations and a stationary state, allowing dynamical switches between activity regimes.
[ { "created": "Mon, 16 Jul 2018 09:06:42 GMT", "version": "v1" } ]
2018-07-18
[ [ "Lazarevich", "Ivan", "" ], [ "Stasenko", "Sergey", "" ], [ "Rozhnova", "Maia", "" ], [ "Pankratova", "Evgeniya", "" ], [ "Dityatev", "Alexander", "" ], [ "Kazantsev", "Victor", "" ] ]
Neuronal and glial cells release diverse proteoglycans and glycoproteins, which aggregate in the extracellular space and form the extracellular matrix (ECM) that may in turn regulate major cellular functions. Brain cells also release extracellular proteases that may degrade the ECM, and both synthesis and degradation of ECM are activity-dependent. In this study we introduce a mathematical model describing population dynamics of neurons interacting with ECM molecules over extended timescales. It is demonstrated that depending on the prevalent biophysical mechanism of ECM-neuronal interactions, different dynamical regimes of ECM activity can be observed, including bistable states with stable stationary levels of ECM molecule concentration, spontaneous ECM oscillations, and coexistence of ECM oscillations and a stationary state, allowing dynamical switches between activity regimes.
2202.03953
Rebecca Walters Ms
Rebecca K. Walters (1), Ella M. Gale (1), Jonathan Barnoud (1), David R. Glowacki (2) and Adrian J. Mulholland (1)
Interactivity: the missing link between virtual reality technology and drug discovery pipelines
19 pages, 3 figures
null
null
null
q-bio.BM
http://creativecommons.org/licenses/by/4.0/
The potential of virtual reality (VR) to contribute to drug design and development has been recognised for many years. Hardware and software developments now mean that this potential is beginning to be realised, and VR methods are being actively used in this sphere. A recent advance is to use VR not only to visualise and interact with molecular structures, but also to interact with molecular dynamics simulations of 'on the fly' (interactive molecular dynamics in VR, IMD-VR), which is useful not only for flexible docking but also to examine binding processes and conformational changes. iMD-VR has been shown to be useful for creating complexes of ligands bound to target proteins, e.g., recently applied to peptide inhibitors of the SARS-CoV-2 main protease. In this review, we use the term 'interactive VR' to refer to software where interactivity is an inherent part of the user VR experience e.g., in making structural modifications or interacting with a physically rigorous molecular dynamics (MD) simulation, as opposed to simply using VR controllers to rotate and translate the molecule for enhanced visualisation. Here, we describe these methods and their application to problems relevant to drug discovery, highlighting the possibilities that they offer in this arena. We suggest that the ease of viewing and manipulating molecular structures and dynamics, and the ability to modify structures on the fly (e.g., adding or deleting atoms) makes modern interactive VR a valuable tool to add to the armoury of drug development methods.
[ { "created": "Tue, 8 Feb 2022 16:03:32 GMT", "version": "v1" } ]
2022-02-09
[ [ "Walters", "Rebecca K.", "" ], [ "Gale", "Ella M.", "" ], [ "Barnoud", "Jonathan", "" ], [ "Glowacki", "David R.", "" ], [ "Mulholland", "Adrian J.", "" ] ]
The potential of virtual reality (VR) to contribute to drug design and development has been recognised for many years. Hardware and software developments now mean that this potential is beginning to be realised, and VR methods are being actively used in this sphere. A recent advance is to use VR not only to visualise and interact with molecular structures, but also to interact with molecular dynamics simulations of 'on the fly' (interactive molecular dynamics in VR, IMD-VR), which is useful not only for flexible docking but also to examine binding processes and conformational changes. iMD-VR has been shown to be useful for creating complexes of ligands bound to target proteins, e.g., recently applied to peptide inhibitors of the SARS-CoV-2 main protease. In this review, we use the term 'interactive VR' to refer to software where interactivity is an inherent part of the user VR experience e.g., in making structural modifications or interacting with a physically rigorous molecular dynamics (MD) simulation, as opposed to simply using VR controllers to rotate and translate the molecule for enhanced visualisation. Here, we describe these methods and their application to problems relevant to drug discovery, highlighting the possibilities that they offer in this arena. We suggest that the ease of viewing and manipulating molecular structures and dynamics, and the ability to modify structures on the fly (e.g., adding or deleting atoms) makes modern interactive VR a valuable tool to add to the armoury of drug development methods.
1412.7519
Helene Montanie
H\'el\`ene Montani\'e (LIENSs), Pascaline Ory (LIENSs), Francis Orvain, Daniel Delmas, Christine Dupuy (LIENSs)
Microbial interactions in marine water amended by eroded benthic biofilm: A case study from an intertidal mudflat
null
Journal of Sea Research, Elsevier, 2014, 92, pp.74 - 85
10.1016/j.seares.2013.11.011
null
q-bio.QM q-bio.PE
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
In shallow macrotidal ecosystems with large intertidal mudflats, the sediment-water coupling plays a crucial role in structuring the pelagic microbial food web functioning, since inorganic and organic matter and microbial components (viruses and microbes) of the microphytobenthic biofilm can be suspended toward the water column. Two experimental bioassays were conducted in March and July 2008 to investigate the importance of biofilm input for the pelagic Microbial and Viral Loops. Pelagic inocula (<0.6$\mu$ and <10$\mu$ filtrates) were diluted either with \textless{}30kDa-ultrafiltered seawater or with this ultrafiltrate enriched with the respective size-fractionated benthic biofilm or with \textless{}30kDa-benthic compounds (BC). The kinetics of heterotrophic nanoflagellates (HNF), bacteria and viruses were assessed together with bacterial and viral genomic fingerprints, bacterial enzymatic activities and viral life strategies. The experimental design allowed us to evaluate the effect of BC modulated by those of benthic size-fractionated microorganisms (virus+bacteria, +HNF). BC presented (1) in March, a positive effect on viruses and bacteria weakened by pelagic HNF. Benthic microorganisms consolidated this negative effect and sustained the viral production together with a relatively diverse and uneven bacterial assemblage structure; (2) in July, no direct impact on viruses but a positive effect on bacteria modulated by HNF, which indirectly enhanced viral multiplication. Both effects were intensified by benthic microorganisms and bacterial assemblage structure became more even. HNF indirectly profited from BC more in March than in July. The Microbial Loop would be stimulated by biofilm during periods of high resources (March) and the Viral Loop during periods of depleted resources (July).
[ { "created": "Tue, 23 Dec 2014 20:50:46 GMT", "version": "v1" } ]
2014-12-24
[ [ "Montanié", "Hélène", "", "LIENSs" ], [ "Ory", "Pascaline", "", "LIENSs" ], [ "Orvain", "Francis", "", "LIENSs" ], [ "Delmas", "Daniel", "", "LIENSs" ], [ "Dupuy", "Christine", "", "LIENSs" ] ]
In shallow macrotidal ecosystems with large intertidal mudflats, the sediment-water coupling plays a crucial role in structuring the pelagic microbial food web functioning, since inorganic and organic matter and microbial components (viruses and microbes) of the microphytobenthic biofilm can be suspended toward the water column. Two experimental bioassays were conducted in March and July 2008 to investigate the importance of biofilm input for the pelagic Microbial and Viral Loops. Pelagic inocula (<0.6$\mu$ and <10$\mu$ filtrates) were diluted either with \textless{}30kDa-ultrafiltered seawater or with this ultrafiltrate enriched with the respective size-fractionated benthic biofilm or with \textless{}30kDa-benthic compounds (BC). The kinetics of heterotrophic nanoflagellates (HNF), bacteria and viruses were assessed together with bacterial and viral genomic fingerprints, bacterial enzymatic activities and viral life strategies. The experimental design allowed us to evaluate the effect of BC modulated by those of benthic size-fractionated microorganisms (virus+bacteria, +HNF). BC presented (1) in March, a positive effect on viruses and bacteria weakened by pelagic HNF. Benthic microorganisms consolidated this negative effect and sustained the viral production together with a relatively diverse and uneven bacterial assemblage structure; (2) in July, no direct impact on viruses but a positive effect on bacteria modulated by HNF, which indirectly enhanced viral multiplication. Both effects were intensified by benthic microorganisms and bacterial assemblage structure became more even. HNF indirectly profited from BC more in March than in July. The Microbial Loop would be stimulated by biofilm during periods of high resources (March) and the Viral Loop during periods of depleted resources (July).
1506.06138
Simon DeDeo
Sarah E. Marzen, Simon DeDeo
The evolution of lossy compression
14 pages, 4 figures
Journal of the Royal Society Interface 14: 20170166 (2017)
10.1098/rsif.2017.0166
null
q-bio.NC cs.IT math.IT nlin.AO physics.soc-ph q-bio.PE
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
In complex environments, there are costs to both ignorance and perception. An organism needs to track fitness-relevant information about its world, but the more information it tracks, the more resources it must devote to memory and processing. Rate-distortion theory shows that, when errors are allowed, remarkably efficient internal representations can be found by biologically-plausible hill-climbing mechanisms. We identify two regimes: a high-fidelity regime where perceptual costs scale logarithmically with environmental complexity, and a low-fidelity regime where perceptual costs are, remarkably, independent of the environment. When environmental complexity is rising, Darwinian evolution should drive organisms to the threshold between the high- and low-fidelity regimes. Organisms that code efficiently will find themselves able to make, just barely, the most subtle distinctions in their environment.
[ { "created": "Fri, 19 Jun 2015 20:00:31 GMT", "version": "v1" } ]
2018-10-17
[ [ "Marzen", "Sarah E.", "" ], [ "DeDeo", "Simon", "" ] ]
In complex environments, there are costs to both ignorance and perception. An organism needs to track fitness-relevant information about its world, but the more information it tracks, the more resources it must devote to memory and processing. Rate-distortion theory shows that, when errors are allowed, remarkably efficient internal representations can be found by biologically-plausible hill-climbing mechanisms. We identify two regimes: a high-fidelity regime where perceptual costs scale logarithmically with environmental complexity, and a low-fidelity regime where perceptual costs are, remarkably, independent of the environment. When environmental complexity is rising, Darwinian evolution should drive organisms to the threshold between the high- and low-fidelity regimes. Organisms that code efficiently will find themselves able to make, just barely, the most subtle distinctions in their environment.
2004.00261
Seung Ki Baek
Yohsuke Murase and Seung Ki Baek
Five rules for friendly rivalry in direct reciprocity
21 pages, 8 figures
Sci. Rep. 10, 16904 (2020)
10.1038/s41598-020-73855-x
null
q-bio.PE
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
Direct reciprocity is one of the key mechanisms accounting for cooperation in our social life. According to recent understanding, most of classical strategies for direct reciprocity fall into one of two classes, `partners' or `rivals'. A `partner' is a generous strategy achieving mutual cooperation, and a `rival' never lets the co-player become better off. They have different working conditions: For example, partners show good performance in a large population, whereas rivals do in head-to-head matches. By means of exhaustive enumeration, we demonstrate the existence of strategies that act as both partners and rivals. Among them, we focus on a human-interpretable strategy, named `CAPRI' after its five characteristic ingredients, i.e., cooperate, accept, punish, recover, and defect otherwise. Our evolutionary simulation shows excellent performance of CAPRI in a broad range of environmental conditions.
[ { "created": "Wed, 1 Apr 2020 07:22:04 GMT", "version": "v1" }, { "created": "Fri, 9 Oct 2020 14:03:39 GMT", "version": "v2" } ]
2020-10-12
[ [ "Murase", "Yohsuke", "" ], [ "Baek", "Seung Ki", "" ] ]
Direct reciprocity is one of the key mechanisms accounting for cooperation in our social life. According to recent understanding, most of classical strategies for direct reciprocity fall into one of two classes, `partners' or `rivals'. A `partner' is a generous strategy achieving mutual cooperation, and a `rival' never lets the co-player become better off. They have different working conditions: For example, partners show good performance in a large population, whereas rivals do in head-to-head matches. By means of exhaustive enumeration, we demonstrate the existence of strategies that act as both partners and rivals. Among them, we focus on a human-interpretable strategy, named `CAPRI' after its five characteristic ingredients, i.e., cooperate, accept, punish, recover, and defect otherwise. Our evolutionary simulation shows excellent performance of CAPRI in a broad range of environmental conditions.
1708.08837
Jacopo Grilli
Theo Gibbs, Jacopo Grilli, Tim Rogers, Stefano Allesina
The effect of population abundances on the stability of large random ecosystems
23 pages, 12 figures
Phys. Rev. E 98, 022410 (2018)
10.1103/PhysRevE.98.022410
null
q-bio.PE cond-mat.stat-mech physics.bio-ph
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
Random matrix theory successfully connects the structure of interactions of large ecological communities to their ability to respond to perturbations. One of the most debated aspects of this approach is the missing role of population abundances. Despite being one of the most studied patterns in ecology, and one of the most empirically accessible quantities, population abundances are always neglected in random matrix approaches and their role in determining stability is still not understood. Here, we tackle this question by explicitly including population abundances in a random matrix framework. We obtain an analytical formula that describes the spectrum of a large community matrix for arbitrary feasible species abundance distributions. The emerging picture is remarkably simple: while population abundances affect the rate to return to equilibrium after a perturbation, the stability of large ecosystems is uniquely determined by the interaction matrix. We confirm this result by showing that the likelihood of having a feasible and unstable solution in the Lotka-Volterra system of equations decreases exponentially with the number of species for stable interaction matrices.
[ { "created": "Tue, 29 Aug 2017 15:52:53 GMT", "version": "v1" } ]
2018-09-12
[ [ "Gibbs", "Theo", "" ], [ "Grilli", "Jacopo", "" ], [ "Rogers", "Tim", "" ], [ "Allesina", "Stefano", "" ] ]
Random matrix theory successfully connects the structure of interactions of large ecological communities to their ability to respond to perturbations. One of the most debated aspects of this approach is the missing role of population abundances. Despite being one of the most studied patterns in ecology, and one of the most empirically accessible quantities, population abundances are always neglected in random matrix approaches and their role in determining stability is still not understood. Here, we tackle this question by explicitly including population abundances in a random matrix framework. We obtain an analytical formula that describes the spectrum of a large community matrix for arbitrary feasible species abundance distributions. The emerging picture is remarkably simple: while population abundances affect the rate to return to equilibrium after a perturbation, the stability of large ecosystems is uniquely determined by the interaction matrix. We confirm this result by showing that the likelihood of having a feasible and unstable solution in the Lotka-Volterra system of equations decreases exponentially with the number of species for stable interaction matrices.
2303.06047
Xin Li
Xin Li, Bin Liu, and Shuo Wang
Toward NeuroDM: Where Computational Neuroscience Meets Data Mining
null
null
null
null
q-bio.NC cs.NE
http://creativecommons.org/publicdomain/zero/1.0/
At the intersection of computational neuroscience (CN) and data mining (DM), we advocate a holistic view toward their rich connections. On the one hand, fundamental concepts in neuroscience such as saliency, memory, and emotion can find novel applications in data mining. On the other hand, multimodal imaging has opened the door for data mining to facilitate the extraction of important cognitive and behavioral information from multimodal neural data. By NeuroDM, we advocate for more collaboration between CN and DM to expedite the advances in two well-established fields. The analogy between the over-parameterization of biological and artificial neural networks might suggest a unifying perspective of advancing both fields.
[ { "created": "Tue, 7 Mar 2023 19:48:13 GMT", "version": "v1" } ]
2023-03-13
[ [ "Li", "Xin", "" ], [ "Liu", "Bin", "" ], [ "Wang", "Shuo", "" ] ]
At the intersection of computational neuroscience (CN) and data mining (DM), we advocate a holistic view toward their rich connections. On the one hand, fundamental concepts in neuroscience such as saliency, memory, and emotion can find novel applications in data mining. On the other hand, multimodal imaging has opened the door for data mining to facilitate the extraction of important cognitive and behavioral information from multimodal neural data. By NeuroDM, we advocate for more collaboration between CN and DM to expedite the advances in two well-established fields. The analogy between the over-parameterization of biological and artificial neural networks might suggest a unifying perspective of advancing both fields.
1501.01455
Institut Pasteur Tunis
Oussema Souiai (TAGCTAGC), Fatma Guerfali, Slimane Ben Miled, Christine Brun (TAGCTAGC), Alia Benkahla
In silico prediction of protein-protein interactions in human macrophages
null
BMC Research Notes, BioMed Central, 2014, 7, pp.157
10.1073/pnas.091062498
null
q-bio.MN
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
Background: Protein-protein interaction (PPI) network analyses are highly valuable in deciphering and understanding the intricate organisation of cellular functions. Nevertheless, the majority of available protein-protein interaction networks are context-less, i.e. without any reference to the spatial, temporal or physiological conditions in which the interactions may occur. In this work, we are proposing a protocol to infer the most likely protein-protein interaction (PPI) network in human macrophages. Results: We integrated the PPI dataset from the Agile Protein Interaction DataAnalyzer (APID) with different meta-data to infer a contextualized macrophage-specific interactome using a combination of statistical methods. The obtained interactome is enriched in experimentally verified interactions and in proteins involved in macrophage-related biological processes (i.e. immune response activation, regulation of apoptosis). As a case study, we used the contextualized interactome to highlight the cellular processes induced upon Mycobacterium tuberculosis infection. Conclusion: Our work confirms that contextualizing interactomes improves the biological significance of bioinformatic analyses. More specifically, studying such inferred network rather than focusing at the gene expression level only, is informative on the processes involved in the host response. Indeed, important immune features such as apoptosis are solely highlighted when the spotlight is on the protein interaction level.
[ { "created": "Wed, 7 Jan 2015 12:06:51 GMT", "version": "v1" } ]
2015-01-08
[ [ "Souiai", "Oussema", "", "TAGCTAGC" ], [ "Guerfali", "Fatma", "", "TAGCTAGC" ], [ "Miled", "Slimane Ben", "", "TAGCTAGC" ], [ "Brun", "Christine", "", "TAGCTAGC" ], [ "Benkahla", "Alia", "" ] ]
Background: Protein-protein interaction (PPI) network analyses are highly valuable in deciphering and understanding the intricate organisation of cellular functions. Nevertheless, the majority of available protein-protein interaction networks are context-less, i.e. without any reference to the spatial, temporal or physiological conditions in which the interactions may occur. In this work, we are proposing a protocol to infer the most likely protein-protein interaction (PPI) network in human macrophages. Results: We integrated the PPI dataset from the Agile Protein Interaction DataAnalyzer (APID) with different meta-data to infer a contextualized macrophage-specific interactome using a combination of statistical methods. The obtained interactome is enriched in experimentally verified interactions and in proteins involved in macrophage-related biological processes (i.e. immune response activation, regulation of apoptosis). As a case study, we used the contextualized interactome to highlight the cellular processes induced upon Mycobacterium tuberculosis infection. Conclusion: Our work confirms that contextualizing interactomes improves the biological significance of bioinformatic analyses. More specifically, studying such inferred network rather than focusing at the gene expression level only, is informative on the processes involved in the host response. Indeed, important immune features such as apoptosis are solely highlighted when the spotlight is on the protein interaction level.
1709.02963
Leo Bronstein
Leo Bronstein, Heinz Koeppl
A variational approach to moment-closure approximations for the kinetics of biomolecular reaction networks
Minor changes and clarifications; corrected some typos
The Journal of Chemical Physics 148, 014105 (2018)
10.1063/1.5003892
null
q-bio.QM physics.chem-ph
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
Approximate solutions of the chemical master equation and the chemical Fokker-Planck equation are an important tool in the analysis of biomolecular reaction networks. Previous studies have highlighted a number of problems with the moment-closure approach used to obtain such approximations, calling it an ad-hoc method. In this article, we give a new variational derivation of moment-closure equations which provides us with an intuitive understanding of their properties and failure modes and allows us to correct some of these problems. We use mixtures of product-Poisson distributions to obtain a flexible parametric family which solves the commonly observed problem of divergences at low system sizes. We also extend the recently introduced entropic matching approach to arbitrary ansatz distributions and Markov processes, demonstrating that it is a special case of variational moment closure. This provides us with a particularly principled approximation method. Finally, we extend the above approaches to cover the approximation of multi-time joint distributions, resulting in a viable alternative to process-level approximations which are often intractable.
[ { "created": "Sat, 9 Sep 2017 15:17:24 GMT", "version": "v1" }, { "created": "Mon, 20 Nov 2017 15:12:25 GMT", "version": "v2" } ]
2018-05-22
[ [ "Bronstein", "Leo", "" ], [ "Koeppl", "Heinz", "" ] ]
Approximate solutions of the chemical master equation and the chemical Fokker-Planck equation are an important tool in the analysis of biomolecular reaction networks. Previous studies have highlighted a number of problems with the moment-closure approach used to obtain such approximations, calling it an ad-hoc method. In this article, we give a new variational derivation of moment-closure equations which provides us with an intuitive understanding of their properties and failure modes and allows us to correct some of these problems. We use mixtures of product-Poisson distributions to obtain a flexible parametric family which solves the commonly observed problem of divergences at low system sizes. We also extend the recently introduced entropic matching approach to arbitrary ansatz distributions and Markov processes, demonstrating that it is a special case of variational moment closure. This provides us with a particularly principled approximation method. Finally, we extend the above approaches to cover the approximation of multi-time joint distributions, resulting in a viable alternative to process-level approximations which are often intractable.
1108.4790
Hiroshi Kori
Hiroshi Kori, Yoji Kawamura, Naoki Masuda
Structure of Cell Networks Critically Determines Oscillation Regularity
null
Journal of Theoretical Biology 297, 61-72 (2012)
10.1016/j.jtbi.2011.12.007
null
q-bio.CB nlin.AO
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
Biological rhythms are generated by pacemaker organs, such as the heart pacemaker organ (the sinoatrial node) and the master clock of the circadian rhythms (the suprachiasmatic nucleus), which are composed of a network of autonomously oscillatory cells. Such biological rhythms have notable periodicity despite the internal and external noise present in each cell. Previous experimental studies indicate that the regularity of oscillatory dynamics is enhanced when noisy oscillators interact and become synchronized. This effect, called the collective enhancement of temporal precision, has been studied theoretically using particular assumptions. In this study, we propose a general theoretical framework that enables us to understand the dependence of temporal precision on network parameters including size, connectivity, and coupling intensity; this effect has been poorly understood to date. Our framework is based on a phase oscillator model that is applicable to general oscillator networks with any coupling mechanism if coupling and noise are sufficiently weak. In particular, we can manage general directed and weighted networks. We quantify the precision of the activity of a single cell and the mean activity of an arbitrary subset of cells. We find that, in general undirected networks, the standard deviation of cycle-to-cycle periods scales with the system size $N$ as $1/\sqrt{N}$, but only up to a certain system size $N^*$ that depends on network parameters. Enhancement of temporal precision is ineffective when $N>N^*$. We also reveal the advantage of long-range interactions among cells to temporal precision.
[ { "created": "Wed, 24 Aug 2011 09:02:38 GMT", "version": "v1" } ]
2016-08-23
[ [ "Kori", "Hiroshi", "" ], [ "Kawamura", "Yoji", "" ], [ "Masuda", "Naoki", "" ] ]
Biological rhythms are generated by pacemaker organs, such as the heart pacemaker organ (the sinoatrial node) and the master clock of the circadian rhythms (the suprachiasmatic nucleus), which are composed of a network of autonomously oscillatory cells. Such biological rhythms have notable periodicity despite the internal and external noise present in each cell. Previous experimental studies indicate that the regularity of oscillatory dynamics is enhanced when noisy oscillators interact and become synchronized. This effect, called the collective enhancement of temporal precision, has been studied theoretically using particular assumptions. In this study, we propose a general theoretical framework that enables us to understand the dependence of temporal precision on network parameters including size, connectivity, and coupling intensity; this effect has been poorly understood to date. Our framework is based on a phase oscillator model that is applicable to general oscillator networks with any coupling mechanism if coupling and noise are sufficiently weak. In particular, we can manage general directed and weighted networks. We quantify the precision of the activity of a single cell and the mean activity of an arbitrary subset of cells. We find that, in general undirected networks, the standard deviation of cycle-to-cycle periods scales with the system size $N$ as $1/\sqrt{N}$, but only up to a certain system size $N^*$ that depends on network parameters. Enhancement of temporal precision is ineffective when $N>N^*$. We also reveal the advantage of long-range interactions among cells to temporal precision.
1704.02780
Maurizio Mattia
Matteo Biggio, Marco Storace, Maurizio Mattia
Equivalence between synaptic current dynamics and heterogeneous propagation delays in spiking neuron networks
14 pages, 5 figures, submitted for publication
null
10.1371/journal.pcbi.1007404
null
q-bio.NC cond-mat.dis-nn
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
Message passing between components of a distributed physical system is non-instantaneous and contributes to determine the time scales of the emerging collective dynamics like an effective inertia. In biological neuron networks this inertia is due in part to local synaptic filtering of exchanged spikes, and in part to the distribution of the axonal transmission delays. How differently these two kinds of inertia affect the network dynamics is an open issue not yet addressed due to the difficulties in dealing with the non-Markovian nature of synaptic transmission. Here, we develop a mean-field dimensional reduction yielding to an effective Markovian dynamics of the population density of the neuronal membrane potential, valid under the hypothesis of small fluctuations of the synaptic current. The resulting theory allows us to prove the formal equivalence between local and distributed inertia, holding for any synaptic time scale, integrate-and-fire neuron model, spike emission regimes and for different network states even when the neuron number is finite.
[ { "created": "Mon, 10 Apr 2017 09:37:38 GMT", "version": "v1" } ]
2019-10-15
[ [ "Biggio", "Matteo", "" ], [ "Storace", "Marco", "" ], [ "Mattia", "Maurizio", "" ] ]
Message passing between components of a distributed physical system is non-instantaneous and contributes to determine the time scales of the emerging collective dynamics like an effective inertia. In biological neuron networks this inertia is due in part to local synaptic filtering of exchanged spikes, and in part to the distribution of the axonal transmission delays. How differently these two kinds of inertia affect the network dynamics is an open issue not yet addressed due to the difficulties in dealing with the non-Markovian nature of synaptic transmission. Here, we develop a mean-field dimensional reduction yielding to an effective Markovian dynamics of the population density of the neuronal membrane potential, valid under the hypothesis of small fluctuations of the synaptic current. The resulting theory allows us to prove the formal equivalence between local and distributed inertia, holding for any synaptic time scale, integrate-and-fire neuron model, spike emission regimes and for different network states even when the neuron number is finite.
1905.02335
Nan Xu
Nan Xu
Deep phenotyping in C. elegans
null
null
null
null
q-bio.QM
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
Deep phenotyping study has become an emerging field to understand the gene function and the structure of biological networks. For the living animal C. elegans, recent advances in genome-editing tools, microfluidic devices and phenotypic analyses allow for a deeper understanding of the genotype-to-phenotype pathway. In this article, I reviewed the evolution of deep phenotyping study in cell development, neuron activity, and the behaviors of intact animals.
[ { "created": "Tue, 7 May 2019 02:46:50 GMT", "version": "v1" } ]
2019-05-08
[ [ "Xu", "Nan", "" ] ]
Deep phenotyping study has become an emerging field to understand the gene function and the structure of biological networks. For the living animal C. elegans, recent advances in genome-editing tools, microfluidic devices and phenotypic analyses allow for a deeper understanding of the genotype-to-phenotype pathway. In this article, I reviewed the evolution of deep phenotyping study in cell development, neuron activity, and the behaviors of intact animals.
1502.00726
Frank Poelwijk
Frank J. Poelwijk, Vinod Krishna, Rama Ranganathan
The context-dependence of mutations: a linkage of formalisms
6 pages, 3 figures, supplementary information
null
10.1371/journal.pcbi.1004771
null
q-bio.QM q-bio.PE
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
Defining the extent of epistasis - the non-independence of the effects of mutations - is essential for understanding the relationship of genotype, phenotype, and fitness in biological systems. The applications cover many areas of biological research, including biochemistry, genomics, protein and systems engineering, medicine, and evolutionary biology. However, the quantitative definitions of epistasis vary among fields, and its analysis beyond just pairwise effects remains obscure in general. Here, we show that different definitions of epistasis are versions of a single mathematical formalism - the weighted Walsh-Hadamard transform. We discuss that one of the definitions, the backgound-averaged epistasis, is the most informative when the goal is to uncover the general epistatic structure of a biological system, a description that can be rather different from the local epistatic structure of specific model systems. Key issues are the choice of effective ensembles for averaging and to practically contend with the vast combinatorial complexity of mutations. In this regard, we discuss possible approaches for optimally learning the epistatic structure of biological systems.
[ { "created": "Tue, 3 Feb 2015 03:49:32 GMT", "version": "v1" }, { "created": "Wed, 22 Apr 2015 18:43:39 GMT", "version": "v2" } ]
2016-07-06
[ [ "Poelwijk", "Frank J.", "" ], [ "Krishna", "Vinod", "" ], [ "Ranganathan", "Rama", "" ] ]
Defining the extent of epistasis - the non-independence of the effects of mutations - is essential for understanding the relationship of genotype, phenotype, and fitness in biological systems. The applications cover many areas of biological research, including biochemistry, genomics, protein and systems engineering, medicine, and evolutionary biology. However, the quantitative definitions of epistasis vary among fields, and its analysis beyond just pairwise effects remains obscure in general. Here, we show that different definitions of epistasis are versions of a single mathematical formalism - the weighted Walsh-Hadamard transform. We discuss that one of the definitions, the backgound-averaged epistasis, is the most informative when the goal is to uncover the general epistatic structure of a biological system, a description that can be rather different from the local epistatic structure of specific model systems. Key issues are the choice of effective ensembles for averaging and to practically contend with the vast combinatorial complexity of mutations. In this regard, we discuss possible approaches for optimally learning the epistatic structure of biological systems.
2001.09400
Jie Wen
Jie Wen, Feiyan Zeng, Dmitriy Yablonskiy, Alexander Sukstansky, Ying Liu, Bin Cai, Yong Zhang, Weifu Lv
Fast library-driven approach for implementation of the voxel spread function technique for correcting magnetic field inhomogeneity artifacts
14 pages, 5 figures
null
null
null
q-bio.QM eess.IV
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
Purpose: Previously-developed Voxel Spread Function (VSF) method (Yablonskiy, et al, MRM, 2013;70:1283) provides means to correct artifacts induced by macroscopic magnetic field inhomogeneities in the images obtained by multi-Gradient-Recalled-Echo (mGRE) techniques. The goal of this study is to develop a library-driven approach for fast VSF implementation. Methods: The VSF approach describes the contribution of the magnetic field inhomogeneity effects on the mGRE signal decay in terms of the F-function calculated from mGRE phase and magnitude images. A pre-calculated library accounting for a variety of background field gradients caused by magnetic field inhomogeneities was used herein to speed up calculation of the F-function and to generate quantitative R2* maps from the mGRE data collected from two healthy volunteers. Results: As compared with direct calculation of the F-function based on a voxel-wise approach, the new library-driven method substantially reduces computational time from several hours to few minutes, while, at the same time, providing similar accuracy of R2* mapping. Conclusion: The new procedure proposed in this study provides a fast post-processing algorithm that can be incorporated in the quantitative analysis of mGRE data to account for background field inhomogeneity artifacts, thus can facilitate the applications of mGRE-based quantitative techniques in clinical practices.
[ { "created": "Sun, 26 Jan 2020 05:09:38 GMT", "version": "v1" } ]
2020-01-28
[ [ "Wen", "Jie", "" ], [ "Zeng", "Feiyan", "" ], [ "Yablonskiy", "Dmitriy", "" ], [ "Sukstansky", "Alexander", "" ], [ "Liu", "Ying", "" ], [ "Cai", "Bin", "" ], [ "Zhang", "Yong", "" ], [ "Lv", "W...
Purpose: Previously-developed Voxel Spread Function (VSF) method (Yablonskiy, et al, MRM, 2013;70:1283) provides means to correct artifacts induced by macroscopic magnetic field inhomogeneities in the images obtained by multi-Gradient-Recalled-Echo (mGRE) techniques. The goal of this study is to develop a library-driven approach for fast VSF implementation. Methods: The VSF approach describes the contribution of the magnetic field inhomogeneity effects on the mGRE signal decay in terms of the F-function calculated from mGRE phase and magnitude images. A pre-calculated library accounting for a variety of background field gradients caused by magnetic field inhomogeneities was used herein to speed up calculation of the F-function and to generate quantitative R2* maps from the mGRE data collected from two healthy volunteers. Results: As compared with direct calculation of the F-function based on a voxel-wise approach, the new library-driven method substantially reduces computational time from several hours to few minutes, while, at the same time, providing similar accuracy of R2* mapping. Conclusion: The new procedure proposed in this study provides a fast post-processing algorithm that can be incorporated in the quantitative analysis of mGRE data to account for background field inhomogeneity artifacts, thus can facilitate the applications of mGRE-based quantitative techniques in clinical practices.
1304.2616
Jonathan Tennant
Jonathan Tennant
Osteology of a Near-Complete Skeleton of Tenontosaurus tilletti (Dinosauria: Ornithopoda) from the Cloverly Formation, Montana, USA
Also uploaded to Figshare (http://dx.doi.org/10.6084/m9.figshare.638693); Masters Thesis
null
null
null
q-bio.PE
http://creativecommons.org/licenses/by/3.0/
The character diagnosis of Tenontosaurus tilletti has been revised and redefined into a more robust and quantifiable state. Significant emphasis is placed on constructing phylogenetic definition in such a method, as it prevents occlusion of true character states by alleviating potential individual interpretational bias. Previous placement within the Iguanodontia is refuted based on the lack of character affinity with the defining synapomorphies of the clade. The clade Hypsilophodontidae (=Hypsilophodontia), along with Iguanodontia, however is deemed to be in critical need of refinement to account for recent discoveries and re-classifications of certain euornithopods. Several of the synapomorphies are out-dated and deemed redundant in favour of a more quantifiable approach. Re- definition of these clades is critical if the current state of basal euornithopodan relationships is to be resolved. Phylogenetic studies must be approached from a multidisciplinary perspective; integration of tectonostratigraphical, ontogenetic, palaeoecological, and biomechanical data with sets of well-defined primary homologies are essential in increasing phylogenetic resolution and generating stratigraphically feasible ancestor-descendant relationships. Material attributed to Tenontosaurus tilletti is in need of strict re-analysis; the significant quantity of specimens attributed to this species is potentially the result of poor stratigraphic constraints and the vast spatiotemporal span occupied. Future revision of this material is expected to reveal temporal variations on the species -level inherently linked to environmental evolution, as well as possibly provide clues to sexual dimorphism in contemporaneous, yet morphologically distinct tenontosaurs.
[ { "created": "Tue, 9 Apr 2013 14:40:33 GMT", "version": "v1" } ]
2013-04-10
[ [ "Tennant", "Jonathan", "" ] ]
The character diagnosis of Tenontosaurus tilletti has been revised and redefined into a more robust and quantifiable state. Significant emphasis is placed on constructing phylogenetic definition in such a method, as it prevents occlusion of true character states by alleviating potential individual interpretational bias. Previous placement within the Iguanodontia is refuted based on the lack of character affinity with the defining synapomorphies of the clade. The clade Hypsilophodontidae (=Hypsilophodontia), along with Iguanodontia, however is deemed to be in critical need of refinement to account for recent discoveries and re-classifications of certain euornithopods. Several of the synapomorphies are out-dated and deemed redundant in favour of a more quantifiable approach. Re- definition of these clades is critical if the current state of basal euornithopodan relationships is to be resolved. Phylogenetic studies must be approached from a multidisciplinary perspective; integration of tectonostratigraphical, ontogenetic, palaeoecological, and biomechanical data with sets of well-defined primary homologies are essential in increasing phylogenetic resolution and generating stratigraphically feasible ancestor-descendant relationships. Material attributed to Tenontosaurus tilletti is in need of strict re-analysis; the significant quantity of specimens attributed to this species is potentially the result of poor stratigraphic constraints and the vast spatiotemporal span occupied. Future revision of this material is expected to reveal temporal variations on the species -level inherently linked to environmental evolution, as well as possibly provide clues to sexual dimorphism in contemporaneous, yet morphologically distinct tenontosaurs.
1512.08339
Dongmei Shi
Dongmei Shi, Chitin Shih, Yenjen Lin, Chungchuan Lo, and Annshyn Chiang
Detecting local processing unit in drosophila brain by using network theory
null
null
null
null
q-bio.NC physics.bio-ph
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
Community detection method in network theory was applied to the neuron network constructed from the image overlapping between neuron pairs to detect the Local Processing Unit (LPU) automatically in Drosophila brain. 26 communities consistent with the known LPUs, and 13 subdivisions were found. Besides, 45 tracts were detected and could be discriminated from the LPUs by analyzing the distribution of participation coefficient P. Furthermore, layer structures in fan-shaped body (FB) were observed which coincided with the images shot by the optical devices, and a total of 13 communities were proven closely related to FB. The method proposed in this work was proven effective to identify the LPU structure in Drosophila brain irrespectively of any subjective aspect, and could be applied to the relevant areas extensively.
[ { "created": "Mon, 28 Dec 2015 08:00:27 GMT", "version": "v1" } ]
2015-12-29
[ [ "Shi", "Dongmei", "" ], [ "Shih", "Chitin", "" ], [ "Lin", "Yenjen", "" ], [ "Lo", "Chungchuan", "" ], [ "Chiang", "Annshyn", "" ] ]
Community detection method in network theory was applied to the neuron network constructed from the image overlapping between neuron pairs to detect the Local Processing Unit (LPU) automatically in Drosophila brain. 26 communities consistent with the known LPUs, and 13 subdivisions were found. Besides, 45 tracts were detected and could be discriminated from the LPUs by analyzing the distribution of participation coefficient P. Furthermore, layer structures in fan-shaped body (FB) were observed which coincided with the images shot by the optical devices, and a total of 13 communities were proven closely related to FB. The method proposed in this work was proven effective to identify the LPU structure in Drosophila brain irrespectively of any subjective aspect, and could be applied to the relevant areas extensively.
2310.10966
Federica Ferretti
Federica Ferretti and Mehran Kardar
Universal characterization of epitope immunodominance from a multi-scale model of clonal competition in germinal centers
10 pages + 3 pages (appendix), 6 figures
null
null
null
q-bio.PE cond-mat.stat-mech physics.bio-ph
http://creativecommons.org/licenses/by/4.0/
We introduce a novel, multi-scale model for affinity maturation, which aims to capture the intra-clonal, inter-clonal and epitope-specific organization of the B cell population in a germinal center. We describe the evolution of the B cell population via a quasispecies dynamics, with species corresponding to unique B cell receptors (BCRs), where the desired multi-scale structure is reflected on the mutational connectivity of the accessible BCR space, and on the statistical properties of its fitness landscape. Within this mathematical framework, we study the competition among classes of BCRs targeting different antigen epitopes, and construct an effective \emph{immunogenic space} where epitope immunodominance relations can be universally characterized. We finally study how varying the relative composition of a mixture of antigens with variable and conserved domains allows for a parametric exploration of this space, and identify general principles for the rational design of two-antigen cocktails.
[ { "created": "Tue, 17 Oct 2023 03:28:05 GMT", "version": "v1" }, { "created": "Wed, 31 Jan 2024 20:12:29 GMT", "version": "v2" } ]
2024-02-02
[ [ "Ferretti", "Federica", "" ], [ "Kardar", "Mehran", "" ] ]
We introduce a novel, multi-scale model for affinity maturation, which aims to capture the intra-clonal, inter-clonal and epitope-specific organization of the B cell population in a germinal center. We describe the evolution of the B cell population via a quasispecies dynamics, with species corresponding to unique B cell receptors (BCRs), where the desired multi-scale structure is reflected on the mutational connectivity of the accessible BCR space, and on the statistical properties of its fitness landscape. Within this mathematical framework, we study the competition among classes of BCRs targeting different antigen epitopes, and construct an effective \emph{immunogenic space} where epitope immunodominance relations can be universally characterized. We finally study how varying the relative composition of a mixture of antigens with variable and conserved domains allows for a parametric exploration of this space, and identify general principles for the rational design of two-antigen cocktails.
2009.04935
Ayan Paul
Ayan Paul, Philipp Englert and Melinda Varga
Socio-economic disparities and COVID-19 in the USA
10 pages, 5 figures and 1 table
null
10.1088/2632-072X/ac0fc7
DESY 20-134, HU-EP-20/20
q-bio.PE physics.soc-ph
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
COVID-19 is not a universal killer. We study the spread of COVID-19 at the county level for the United States up until the 15$^{th}$ of August, 2020. We show that the prevalence of the disease and the death rate are correlated with the local socio-economic conditions often going beyond local population density distributions, especially in rural areas. We correlate the COVID-19 prevalence and death rate with data from the US Census Bureau and point out how the spreading patterns of the disease show asymmetries in urban and rural areas separately and are preferentially affecting the counties where a large fraction of the population is non-white. Our findings can be used for more targeted policy building and deployment of resources for future occurrence of a pandemic due to SARS-CoV-2. Our methodology, based on interpretable machine learning and game theory, can be extended to study the spread of other diseases.
[ { "created": "Thu, 10 Sep 2020 15:24:45 GMT", "version": "v1" }, { "created": "Wed, 30 Jun 2021 00:01:14 GMT", "version": "v2" } ]
2021-07-01
[ [ "Paul", "Ayan", "" ], [ "Englert", "Philipp", "" ], [ "Varga", "Melinda", "" ] ]
COVID-19 is not a universal killer. We study the spread of COVID-19 at the county level for the United States up until the 15$^{th}$ of August, 2020. We show that the prevalence of the disease and the death rate are correlated with the local socio-economic conditions often going beyond local population density distributions, especially in rural areas. We correlate the COVID-19 prevalence and death rate with data from the US Census Bureau and point out how the spreading patterns of the disease show asymmetries in urban and rural areas separately and are preferentially affecting the counties where a large fraction of the population is non-white. Our findings can be used for more targeted policy building and deployment of resources for future occurrence of a pandemic due to SARS-CoV-2. Our methodology, based on interpretable machine learning and game theory, can be extended to study the spread of other diseases.
1509.07038
Ying-Cheng Lai
Le-Zhi Wang, Ri-Qi Su, Zi-Gang Huang, Xiao Wang, Wenxu Wang, Celso Grebogi, and Ying-Cheng Lai
Control and controllability of nonlinear dynamical networks: a geometrical approach
22 pages, 8 figures
null
null
null
q-bio.MN cs.SY nlin.CD physics.bio-ph
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
In spite of the recent interest and advances in linear controllability of complex networks, controlling nonlinear network dynamics remains to be an outstanding problem. We develop an experimentally feasible control framework for nonlinear dynamical networks that exhibit multistability (multiple coexisting final states or attractors), which are representative of, e.g., gene regulatory networks (GRNs). The control objective is to apply parameter perturbation to drive the system from one attractor to another, assuming that the former is undesired and the latter is desired. To make our framework practically useful, we consider RESTRICTED parameter perturbation by imposing the following two constraints: (a) it must be experimentally realizable and (b) it is applied only temporarily. We introduce the concept of ATTRACTOR NETWORK, in which the nodes are the distinct attractors of the system, and there is a directional link from one attractor to another if the system can be driven from the former to the latter using restricted control perturbation. Introduction of the attractor network allows us to formulate a controllability framework for nonlinear dynamical networks: a network is more controllable if the underlying attractor network is more strongly connected, which can be quantified. We demonstrate our control framework using examples from various models of experimental GRNs. A finding is that, due to nonlinearity, noise can counter-intuitively facilitate control of the network dynamics.
[ { "created": "Wed, 23 Sep 2015 15:48:58 GMT", "version": "v1" } ]
2015-09-24
[ [ "Wang", "Le-Zhi", "" ], [ "Su", "Ri-Qi", "" ], [ "Huang", "Zi-Gang", "" ], [ "Wang", "Xiao", "" ], [ "Wang", "Wenxu", "" ], [ "Grebogi", "Celso", "" ], [ "Lai", "Ying-Cheng", "" ] ]
In spite of the recent interest and advances in linear controllability of complex networks, controlling nonlinear network dynamics remains to be an outstanding problem. We develop an experimentally feasible control framework for nonlinear dynamical networks that exhibit multistability (multiple coexisting final states or attractors), which are representative of, e.g., gene regulatory networks (GRNs). The control objective is to apply parameter perturbation to drive the system from one attractor to another, assuming that the former is undesired and the latter is desired. To make our framework practically useful, we consider RESTRICTED parameter perturbation by imposing the following two constraints: (a) it must be experimentally realizable and (b) it is applied only temporarily. We introduce the concept of ATTRACTOR NETWORK, in which the nodes are the distinct attractors of the system, and there is a directional link from one attractor to another if the system can be driven from the former to the latter using restricted control perturbation. Introduction of the attractor network allows us to formulate a controllability framework for nonlinear dynamical networks: a network is more controllable if the underlying attractor network is more strongly connected, which can be quantified. We demonstrate our control framework using examples from various models of experimental GRNs. A finding is that, due to nonlinearity, noise can counter-intuitively facilitate control of the network dynamics.
1911.09376
Jitesh Jhawar
Jitesh Jhawar (1) and Vishwesha Guttal (1) ((1) Center for Ecological Sciences, Indian Institute of Science, Bangalore, India)
Noise-induced Effects in Collective Dynamics and Inferring Local Interactions from Data
The article has 24 pages containing 5 main figures, 5 supplementary figures, 3 boxes and 1 table insides one of the box
null
null
null
q-bio.PE
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
In animal groups, individual decisions are best characterised by probabilistic rules. Furthermore, animals of many species live in small groups. Probabilistic interactions among small numbers of individuals lead to a so called intrinsic noise at the group level. Theory predicts that the strength of intrinsic noise is not a constant but often depends on the collective state of the group; hence, it is also called a state-dependent noise or a multiplicative noise. Surprisingly, such noise may produce collective order. However, only a few empirical studies on collective behaviour have paid attention to such effects due to the lack of methods that enable us to connect data with theory. Here, we demonstrate a method to characterise the role of stochasticity directly from high-resolution time-series data of collective dynamics. We do this by employing two well-studied individual-based toy models of collective behaviour. We argue that the group-level noise may encode important information about the underlying processes at the individual scale. In summary, we describe a method that enables us to establish connections between empirical data of animal (or cellular) collectives with the phenomenon of noise-induced states, a field that is otherwise largely limited to the theoretical literature.
[ { "created": "Thu, 21 Nov 2019 10:05:38 GMT", "version": "v1" }, { "created": "Tue, 21 Apr 2020 18:11:26 GMT", "version": "v2" } ]
2020-04-23
[ [ "Jhawar", "Jitesh", "" ], [ "Guttal", "Vishwesha", "" ] ]
In animal groups, individual decisions are best characterised by probabilistic rules. Furthermore, animals of many species live in small groups. Probabilistic interactions among small numbers of individuals lead to a so called intrinsic noise at the group level. Theory predicts that the strength of intrinsic noise is not a constant but often depends on the collective state of the group; hence, it is also called a state-dependent noise or a multiplicative noise. Surprisingly, such noise may produce collective order. However, only a few empirical studies on collective behaviour have paid attention to such effects due to the lack of methods that enable us to connect data with theory. Here, we demonstrate a method to characterise the role of stochasticity directly from high-resolution time-series data of collective dynamics. We do this by employing two well-studied individual-based toy models of collective behaviour. We argue that the group-level noise may encode important information about the underlying processes at the individual scale. In summary, we describe a method that enables us to establish connections between empirical data of animal (or cellular) collectives with the phenomenon of noise-induced states, a field that is otherwise largely limited to the theoretical literature.
q-bio/0702026
Robert Finkel
Robert W. Finkel
Effective Potential Energy Expression for Membrane Transport
3 pages in pdf format
null
null
null
q-bio.SC q-bio.QM
null
All living cells transport molecules and ions across membranes, often against concentration gradients. This active transport requires continual energy expenditure and is clearly a nonequilibrium process for which standard equilibrium thermodynamics is not rigorously applicable. Here we derive a nonequilibrium effective potential that evaluates the per particle transport energy invested by the membrane. A novel method is used whereby a Hamiltonian function is constructed using particle concentrations as generalized coordinates. The associated generalized momenta are simply related to the individual particle energy from which we identify the effective potential. Examples are given and the formalism is compared with the equilibrium Gibb's free energy.
[ { "created": "Sun, 11 Feb 2007 21:12:08 GMT", "version": "v1" } ]
2007-05-23
[ [ "Finkel", "Robert W.", "" ] ]
All living cells transport molecules and ions across membranes, often against concentration gradients. This active transport requires continual energy expenditure and is clearly a nonequilibrium process for which standard equilibrium thermodynamics is not rigorously applicable. Here we derive a nonequilibrium effective potential that evaluates the per particle transport energy invested by the membrane. A novel method is used whereby a Hamiltonian function is constructed using particle concentrations as generalized coordinates. The associated generalized momenta are simply related to the individual particle energy from which we identify the effective potential. Examples are given and the formalism is compared with the equilibrium Gibb's free energy.
1409.0528
R.K. Brojen Singh
Gurumayum Reenaroy Devi, Md. Jahoor Alam and R.K. Brojen Singh
Nitric Oxide as stress inducer and synchronizer of p53 dynamics
null
null
null
null
q-bio.MN
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
We study how the temporal behaviours of p53 and MDM2 are affected by stress inducing bioactive molecules NO (Nitric Oxide) in the p53-MDM2-NO regulatory network. We also study synchronization among a group of identical stress systems arranged in a three dimensional array with nearest neighbour diffusive coupling. The role of NO and effect of noise are investigated. In the single system study, we have found three distinct types of temporal behaviour of p53, namely, oscillation death, damped oscillation and sustain oscillation, depending on the amount of stress induced by the NO concentration, indicating how p53 responds to the incoming stress. The correlation among the coupled systems increases as the value of coupling constant (\epsilon) is increased (\gamma increases) and becomes constant after certain value of \epsilon. The permutation entropy spectra H(\epsilon) for p53 and MDM2 as a function of \epsilon are found to be different due to direct and indirect interaction of NO with the respective proteins. \gamma versus \epsilon for p53 and MDM2 are found to be similar in deterministic approach, but different in stochastic approach and the separation between \gamma of the respective proteins as a function of \epsilon decreases as system size increases. The role of NO is found to be twofold: stress induced by it is prominent at small and large values of \epsilon but synchrony inducing by it dominates in moderate range of \epsilon. Excess stress induce apoptosis to the system.
[ { "created": "Mon, 1 Sep 2014 13:07:01 GMT", "version": "v1" } ]
2014-09-03
[ [ "Devi", "Gurumayum Reenaroy", "" ], [ "Alam", "Md. Jahoor", "" ], [ "Singh", "R. K. Brojen", "" ] ]
We study how the temporal behaviours of p53 and MDM2 are affected by stress inducing bioactive molecules NO (Nitric Oxide) in the p53-MDM2-NO regulatory network. We also study synchronization among a group of identical stress systems arranged in a three dimensional array with nearest neighbour diffusive coupling. The role of NO and effect of noise are investigated. In the single system study, we have found three distinct types of temporal behaviour of p53, namely, oscillation death, damped oscillation and sustain oscillation, depending on the amount of stress induced by the NO concentration, indicating how p53 responds to the incoming stress. The correlation among the coupled systems increases as the value of coupling constant (\epsilon) is increased (\gamma increases) and becomes constant after certain value of \epsilon. The permutation entropy spectra H(\epsilon) for p53 and MDM2 as a function of \epsilon are found to be different due to direct and indirect interaction of NO with the respective proteins. \gamma versus \epsilon for p53 and MDM2 are found to be similar in deterministic approach, but different in stochastic approach and the separation between \gamma of the respective proteins as a function of \epsilon decreases as system size increases. The role of NO is found to be twofold: stress induced by it is prominent at small and large values of \epsilon but synchrony inducing by it dominates in moderate range of \epsilon. Excess stress induce apoptosis to the system.
1606.03910
Kishan Manani
Kishan A. Manani, Kim Christensen, Nicholas S. Peters
Myocardial Architecture and Patient Variability in Clinical Patterns of Atrial Fibrillation
5 pages, 4 figures. For supplementary materials please contact Kishan A. Manani at kishan.a.manani@gmail.com
Phys. Rev. E 94, 042401 (2016)
10.1103/PhysRevE.94.042401
null
q-bio.TO physics.bio-ph physics.med-ph
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
Atrial fibrillation (AF) increases the risk of stroke by a factor of four to five and is the most common abnormal heart rhythm. The progression of AF with age, from short self-terminating episodes to persistence, varies between individuals and is poorly understood. An inability to understand and predict variation in AF progression has resulted in less patient-specific therapy. Likewise, it has been a challenge to relate the microstructural features of heart muscle tissue (myocardial architecture) with the emergent temporal clinical patterns of AF. We use a simple model of activation wavefront propagation on an anisotropic structure, mimicking heart muscle tissue, to show how variation in AF behaviour arises naturally from microstructural differences between individuals. We show that the stochastic nature of progressive transversal uncoupling of muscle strands (e.g., due to fibrosis or gap junctional remodelling), as occurs with age, results in variability in AF episode onset time, frequency, duration, burden and progression between individuals. This is consistent with clinical observations. The uncoupling of muscle strands can cause critical architectural patterns in the myocardium. These critical patterns anchor micro-re-entrant wavefronts and thereby trigger AF. It is the number of local critical patterns of uncoupling as opposed to global uncoupling that determines AF progression. This insight may eventually lead to patient specific therapy when it becomes possible to observe the cellular structure of a patient's heart.
[ { "created": "Mon, 13 Jun 2016 12:01:23 GMT", "version": "v1" } ]
2016-10-12
[ [ "Manani", "Kishan A.", "" ], [ "Christensen", "Kim", "" ], [ "Peters", "Nicholas S.", "" ] ]
Atrial fibrillation (AF) increases the risk of stroke by a factor of four to five and is the most common abnormal heart rhythm. The progression of AF with age, from short self-terminating episodes to persistence, varies between individuals and is poorly understood. An inability to understand and predict variation in AF progression has resulted in less patient-specific therapy. Likewise, it has been a challenge to relate the microstructural features of heart muscle tissue (myocardial architecture) with the emergent temporal clinical patterns of AF. We use a simple model of activation wavefront propagation on an anisotropic structure, mimicking heart muscle tissue, to show how variation in AF behaviour arises naturally from microstructural differences between individuals. We show that the stochastic nature of progressive transversal uncoupling of muscle strands (e.g., due to fibrosis or gap junctional remodelling), as occurs with age, results in variability in AF episode onset time, frequency, duration, burden and progression between individuals. This is consistent with clinical observations. The uncoupling of muscle strands can cause critical architectural patterns in the myocardium. These critical patterns anchor micro-re-entrant wavefronts and thereby trigger AF. It is the number of local critical patterns of uncoupling as opposed to global uncoupling that determines AF progression. This insight may eventually lead to patient specific therapy when it becomes possible to observe the cellular structure of a patient's heart.
2209.13886
Priya Chakraborty
Priya Chakraborty and Ushasi Roy and Sayantari Ghosh
Resource competition in Three-gene-motif & Emergence of Feed-forward response: A Spatiotemporal Study
19 pages, 6 figures
null
null
null
q-bio.MN q-bio.QM
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
Feed-forward dynamics, which is well-known to have several important implications in nonlinear dynamical systems, frequently occurs in gene expression motifs, and has been well explored experimentally and mathematically. However, dependency of the components of a genetic circuit upon its host, due to the requirement for resources like ribosome, ATP, transcription factors, tRNA, etc., and related effects are of utmost importance, which is commonly ignored in mathematical models. In a resource-limited environment, two apparently unconnected genes can compete for resources for their respective expression and may exhibit indirect regulatory connection; an emergent response thus arises in the system completely because of resource competition. In this work, we have shown how the responses of the feed-forward loop (FFL), a well-studied regulatory genetic motif, can be recreated considering the resource competition in a three-gene pathway. Exploring the genetic system with temporal as well as spatiotemporal stability analysis, interesting transient and steady-state responses have been observed. The genetic motifs explored in this paper show many of the characteristic features of the conventional FFL structure, like response delay and pulse generation. Most interestingly, in a two-dimensional cellular arrangement, characteristic pattern formation under a concentration gradient of input signals have also been observed. This study pinpoints a larger area of research and exploration in synthetic and cellular systems, which will reveal novel controlling ideas and unique behavioral changes in the system for its context dependencies.
[ { "created": "Wed, 28 Sep 2022 07:38:25 GMT", "version": "v1" }, { "created": "Sun, 7 Jan 2024 05:41:56 GMT", "version": "v2" } ]
2024-01-09
[ [ "Chakraborty", "Priya", "" ], [ "Roy", "Ushasi", "" ], [ "Ghosh", "Sayantari", "" ] ]
Feed-forward dynamics, which is well-known to have several important implications in nonlinear dynamical systems, frequently occurs in gene expression motifs, and has been well explored experimentally and mathematically. However, dependency of the components of a genetic circuit upon its host, due to the requirement for resources like ribosome, ATP, transcription factors, tRNA, etc., and related effects are of utmost importance, which is commonly ignored in mathematical models. In a resource-limited environment, two apparently unconnected genes can compete for resources for their respective expression and may exhibit indirect regulatory connection; an emergent response thus arises in the system completely because of resource competition. In this work, we have shown how the responses of the feed-forward loop (FFL), a well-studied regulatory genetic motif, can be recreated considering the resource competition in a three-gene pathway. Exploring the genetic system with temporal as well as spatiotemporal stability analysis, interesting transient and steady-state responses have been observed. The genetic motifs explored in this paper show many of the characteristic features of the conventional FFL structure, like response delay and pulse generation. Most interestingly, in a two-dimensional cellular arrangement, characteristic pattern formation under a concentration gradient of input signals have also been observed. This study pinpoints a larger area of research and exploration in synthetic and cellular systems, which will reveal novel controlling ideas and unique behavioral changes in the system for its context dependencies.
2202.01521
Robert Rosenbaum
Vicky Zhu and Robert Rosenbaum
Evaluating the extent to which homeostatic plasticity learns to compute prediction errors in unstructured neuronal networks
null
null
null
null
q-bio.NC
http://creativecommons.org/licenses/by/4.0/
The brain is believed to operate in part by making predictions about sensory stimuli and encoding deviations from these predictions in the activity of "prediction error neurons." This principle defines the widely influential theory of predictive coding. The precise circuitry and plasticity mechanisms through which animals learn to compute and update their predictions are unknown. Homeostatic inhibitory synaptic plasticity is a promising mechanism for training neuronal networks to perform predictive coding. Homeostatic plasticity causes neurons to maintain a steady, baseline firing rate in response to inputs that closely match the inputs on which a network was trained, but firing rates can deviate away from this baseline in response to stimuli that are mismatched from training. We combine computer simulations and mathematical analysis systematically to test the extent to which randomly connected, unstructured networks compute prediction errors after training with homeostatic inhibitory synaptic plasticity. We find that homeostatic plasticity alone is sufficient for computing prediction errors for trivial time-constant stimuli, but not for more realistic time-varying stimuli. We use a mean-field theory of plastic networks to explain our findings and characterize the assumptions under which they apply.
[ { "created": "Thu, 3 Feb 2022 11:01:53 GMT", "version": "v1" }, { "created": "Fri, 18 Feb 2022 13:01:11 GMT", "version": "v2" } ]
2022-02-21
[ [ "Zhu", "Vicky", "" ], [ "Rosenbaum", "Robert", "" ] ]
The brain is believed to operate in part by making predictions about sensory stimuli and encoding deviations from these predictions in the activity of "prediction error neurons." This principle defines the widely influential theory of predictive coding. The precise circuitry and plasticity mechanisms through which animals learn to compute and update their predictions are unknown. Homeostatic inhibitory synaptic plasticity is a promising mechanism for training neuronal networks to perform predictive coding. Homeostatic plasticity causes neurons to maintain a steady, baseline firing rate in response to inputs that closely match the inputs on which a network was trained, but firing rates can deviate away from this baseline in response to stimuli that are mismatched from training. We combine computer simulations and mathematical analysis systematically to test the extent to which randomly connected, unstructured networks compute prediction errors after training with homeostatic inhibitory synaptic plasticity. We find that homeostatic plasticity alone is sufficient for computing prediction errors for trivial time-constant stimuli, but not for more realistic time-varying stimuli. We use a mean-field theory of plastic networks to explain our findings and characterize the assumptions under which they apply.
1610.06360
Keith Smith
Keith Smith, Daniel Abasalo and Javier Escudero
Accounting for the Complex Hierarchical Topology of EEG Phase-Based Functional Connectivity in Network Binarisation
Accepted for publication in PLOS One, 27th September 2017
PLoS ONE12(10): e0186164 (2017)
10.1371/journal.pone.0186164
null
q-bio.NC
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
Research into binary network analysis of brain function faces a methodological challenge in selecting an appropriate threshold to binarise edge weights. For EEG phase-based functional connectivity, we test the hypothesis that such binarisation should take into account the complex hierarchical structure found in functional connectivity. We explore the density range suitable for such structure and provide a comparison of state-of-the-art binarisation techniques, the recently proposed Cluster-Span Threshold (CST), minimum spanning trees, efficiency-cost optimisation and union of shortest path graphs, with arbitrary proportional thresholds and weighted networks. We test these techniques on weighted complex hierarchy models by contrasting model realisations with small parametric differences. We also test the robustness of these techniques to random and targeted topological attacks.We find that the CST performs consistenty well in state-of-the-art modelling of EEG network topology, robustness to topological network attacks, and in three real datasets, agreeing with our hypothesis of hierarchical complexity. This provides interesting new evidence into the relevance of considering a large number of edges in EEG functional connectivity research to provide informational density in the topology.
[ { "created": "Thu, 20 Oct 2016 11:19:02 GMT", "version": "v1" }, { "created": "Mon, 6 Mar 2017 12:01:19 GMT", "version": "v2" }, { "created": "Fri, 29 Sep 2017 13:42:05 GMT", "version": "v3" } ]
2017-10-24
[ [ "Smith", "Keith", "" ], [ "Abasalo", "Daniel", "" ], [ "Escudero", "Javier", "" ] ]
Research into binary network analysis of brain function faces a methodological challenge in selecting an appropriate threshold to binarise edge weights. For EEG phase-based functional connectivity, we test the hypothesis that such binarisation should take into account the complex hierarchical structure found in functional connectivity. We explore the density range suitable for such structure and provide a comparison of state-of-the-art binarisation techniques, the recently proposed Cluster-Span Threshold (CST), minimum spanning trees, efficiency-cost optimisation and union of shortest path graphs, with arbitrary proportional thresholds and weighted networks. We test these techniques on weighted complex hierarchy models by contrasting model realisations with small parametric differences. We also test the robustness of these techniques to random and targeted topological attacks.We find that the CST performs consistenty well in state-of-the-art modelling of EEG network topology, robustness to topological network attacks, and in three real datasets, agreeing with our hypothesis of hierarchical complexity. This provides interesting new evidence into the relevance of considering a large number of edges in EEG functional connectivity research to provide informational density in the topology.
2102.10041
Shubhadeep Sadhukhan
Shubhadeep Sadhukhan, Rohitashwa Chattopadhyay, Sagar Chakraborty
Cooperators overcome migration dilemma through synchronization
12 pages, 8 figures
Phys. Rev. Research 3, 013009 (2021)
10.1103/PhysRevResearch.3.013009
null
q-bio.PE physics.bio-ph
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
Synchronization, cooperation, and chaos are ubiquitous phenomena in nature. In a population composed of many distinct groups of individuals playing the prisoner's dilemma game, there exists a migration dilemma: No cooperator would migrate to a group playing the prisoner's dilemma game lest it should be exploited by a defector; but unless the migration takes place, there is no chance of the entire population's cooperator-fraction to increase. Employing a randomly rewired coupled map lattice of chaotic replicator maps, modelling replication-selection evolutionary game dynamics, we demonstrate that the cooperators -- evolving in synchrony -- overcome the migration dilemma to proliferate across the population when altruism is mildly incentivized making few of the demes play the leader game.
[ { "created": "Wed, 17 Feb 2021 06:32:42 GMT", "version": "v1" } ]
2021-02-22
[ [ "Sadhukhan", "Shubhadeep", "" ], [ "Chattopadhyay", "Rohitashwa", "" ], [ "Chakraborty", "Sagar", "" ] ]
Synchronization, cooperation, and chaos are ubiquitous phenomena in nature. In a population composed of many distinct groups of individuals playing the prisoner's dilemma game, there exists a migration dilemma: No cooperator would migrate to a group playing the prisoner's dilemma game lest it should be exploited by a defector; but unless the migration takes place, there is no chance of the entire population's cooperator-fraction to increase. Employing a randomly rewired coupled map lattice of chaotic replicator maps, modelling replication-selection evolutionary game dynamics, we demonstrate that the cooperators -- evolving in synchrony -- overcome the migration dilemma to proliferate across the population when altruism is mildly incentivized making few of the demes play the leader game.
1006.2761
Yuliang Jin
Yuliang Jin, Dmitrij Turaev, Thomas Weinmaier, Thomas Rattei, Hernan A. Makse
The evolutionary dynamics of protein-protein interaction networks inferred from the reconstruction of ancient networks
null
PLoS ONE 2013, Volume 8, Issue 3, e58134
10.1371/journal.pone.0058134
null
q-bio.MN cond-mat.dis-nn physics.bio-ph
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
Cellular functions are based on the complex interplay of proteins, therefore the structure and dynamics of these protein-protein interaction (PPI) networks are the key to the functional understanding of cells. In the last years, large-scale PPI networks of several model organisms were investigated. Methodological improvements now allow the analysis of PPI networks of multiple organisms simultaneously as well as the direct modeling of ancestral networks. This provides the opportunity to challenge existing assumptions on network evolution. We utilized present-day PPI networks from integrated datasets of seven model organisms and developed a theoretical and bioinformatic framework for studying the evolutionary dynamics of PPI networks. A novel filtering approach using percolation analysis was developed to remove low confidence interactions based on topological constraints. We then reconstructed the ancient PPI networks of different ancestors, for which the ancestral proteomes, as well as the ancestral interactions, were inferred. Ancestral proteins were reconstructed using orthologous groups on different evolutionary levels. A stochastic approach, using the duplication-divergence model, was developed for estimating the probabilities of ancient interactions from today's PPI networks. The growth rates for nodes, edges, sizes and modularities of the networks indicate multiplicative growth and are consistent with the results from independent static analysis. Our results support the duplication-divergence model of evolution and indicate fractality and multiplicative growth as general properties of the PPI network structure and dynamics.
[ { "created": "Mon, 14 Jun 2010 16:40:39 GMT", "version": "v1" }, { "created": "Tue, 19 Feb 2013 15:36:49 GMT", "version": "v2" } ]
2013-03-27
[ [ "Jin", "Yuliang", "" ], [ "Turaev", "Dmitrij", "" ], [ "Weinmaier", "Thomas", "" ], [ "Rattei", "Thomas", "" ], [ "Makse", "Hernan A.", "" ] ]
Cellular functions are based on the complex interplay of proteins, therefore the structure and dynamics of these protein-protein interaction (PPI) networks are the key to the functional understanding of cells. In the last years, large-scale PPI networks of several model organisms were investigated. Methodological improvements now allow the analysis of PPI networks of multiple organisms simultaneously as well as the direct modeling of ancestral networks. This provides the opportunity to challenge existing assumptions on network evolution. We utilized present-day PPI networks from integrated datasets of seven model organisms and developed a theoretical and bioinformatic framework for studying the evolutionary dynamics of PPI networks. A novel filtering approach using percolation analysis was developed to remove low confidence interactions based on topological constraints. We then reconstructed the ancient PPI networks of different ancestors, for which the ancestral proteomes, as well as the ancestral interactions, were inferred. Ancestral proteins were reconstructed using orthologous groups on different evolutionary levels. A stochastic approach, using the duplication-divergence model, was developed for estimating the probabilities of ancient interactions from today's PPI networks. The growth rates for nodes, edges, sizes and modularities of the networks indicate multiplicative growth and are consistent with the results from independent static analysis. Our results support the duplication-divergence model of evolution and indicate fractality and multiplicative growth as general properties of the PPI network structure and dynamics.
2403.04142
Karina Silina
Karina Silina, Francesco Ciompi
Hitchhiker's guide to cancer-associated lymphoid aggregates in histology images: manual and deep learning-based quantification approaches
14 pages, 3 figures, 1 table, 3 boxes, protocol/guideline
null
null
null
q-bio.TO cs.CV q-bio.QM
http://creativecommons.org/licenses/by-nc-nd/4.0/
Quantification of lymphoid aggregates including tertiary lymphoid structures with germinal centers in histology images of cancer is a promising approach for developing prognostic and predictive tissue biomarkers. In this article, we provide recommendations for identifying lymphoid aggregates in tissue sections from routine pathology workflows such as hematoxylin and eosin staining. To overcome the intrinsic variability associated with manual image analysis (such as subjective decision making, attention span), we recently developed a deep learning-based algorithm called HookNet-TLS to detect lymphoid aggregates and germinal centers in various tissues. Here, we additionally provide a guideline for using manually annotated images for training and implementing HookNet-TLS for automated and objective quantification of lymphoid aggregates in various cancer types.
[ { "created": "Wed, 6 Mar 2024 15:32:05 GMT", "version": "v1" } ]
2024-03-08
[ [ "Silina", "Karina", "" ], [ "Ciompi", "Francesco", "" ] ]
Quantification of lymphoid aggregates including tertiary lymphoid structures with germinal centers in histology images of cancer is a promising approach for developing prognostic and predictive tissue biomarkers. In this article, we provide recommendations for identifying lymphoid aggregates in tissue sections from routine pathology workflows such as hematoxylin and eosin staining. To overcome the intrinsic variability associated with manual image analysis (such as subjective decision making, attention span), we recently developed a deep learning-based algorithm called HookNet-TLS to detect lymphoid aggregates and germinal centers in various tissues. Here, we additionally provide a guideline for using manually annotated images for training and implementing HookNet-TLS for automated and objective quantification of lymphoid aggregates in various cancer types.
2109.09143
Giuseppe Gaeta
Giuseppe Gaeta
Mass vaccination in a roaring pandemic
13 pages; to appear in "Chaos, Solitons and Fractals"
null
10.1016/j.chaos.2021.111786
null
q-bio.PE
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
Mass vaccination produces a reduction in virus circulation, but also evolutive pressure towards the appearance of virus-resistant strains. We discuss the balance between these two effects, in particular when the mass vaccination takes place in the middle of an epidemic period.
[ { "created": "Sun, 19 Sep 2021 15:17:17 GMT", "version": "v1" }, { "created": "Fri, 31 Dec 2021 18:23:05 GMT", "version": "v2" }, { "created": "Wed, 26 Jan 2022 22:12:12 GMT", "version": "v3" } ]
2022-03-02
[ [ "Gaeta", "Giuseppe", "" ] ]
Mass vaccination produces a reduction in virus circulation, but also evolutive pressure towards the appearance of virus-resistant strains. We discuss the balance between these two effects, in particular when the mass vaccination takes place in the middle of an epidemic period.
1810.01485
Patrick Schwab
Patrick Schwab, Walter Karlen
PhoneMD: Learning to Diagnose Parkinson's Disease from Smartphone Data
AAAI Conference on Artificial Intelligence 2019
null
null
null
q-bio.NC cs.LG
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
Parkinson's disease is a neurodegenerative disease that can affect a person's movement, speech, dexterity, and cognition. Clinicians primarily diagnose Parkinson's disease by performing a clinical assessment of symptoms. However, misdiagnoses are common. One factor that contributes to misdiagnoses is that the symptoms of Parkinson's disease may not be prominent at the time the clinical assessment is performed. Here, we present a machine-learning approach towards distinguishing between people with and without Parkinson's disease using long-term data from smartphone-based walking, voice, tapping and memory tests. We demonstrate that our attentive deep-learning models achieve significant improvements in predictive performance over strong baselines (area under the receiver operating characteristic curve = 0.85) in data from a cohort of 1853 participants. We also show that our models identify meaningful features in the input data. Our results confirm that smartphone data collected over extended periods of time could in the future potentially be used as a digital biomarker for the diagnosis of Parkinson's disease.
[ { "created": "Mon, 1 Oct 2018 11:38:18 GMT", "version": "v1" }, { "created": "Wed, 14 Nov 2018 23:53:32 GMT", "version": "v2" } ]
2018-11-16
[ [ "Schwab", "Patrick", "" ], [ "Karlen", "Walter", "" ] ]
Parkinson's disease is a neurodegenerative disease that can affect a person's movement, speech, dexterity, and cognition. Clinicians primarily diagnose Parkinson's disease by performing a clinical assessment of symptoms. However, misdiagnoses are common. One factor that contributes to misdiagnoses is that the symptoms of Parkinson's disease may not be prominent at the time the clinical assessment is performed. Here, we present a machine-learning approach towards distinguishing between people with and without Parkinson's disease using long-term data from smartphone-based walking, voice, tapping and memory tests. We demonstrate that our attentive deep-learning models achieve significant improvements in predictive performance over strong baselines (area under the receiver operating characteristic curve = 0.85) in data from a cohort of 1853 participants. We also show that our models identify meaningful features in the input data. Our results confirm that smartphone data collected over extended periods of time could in the future potentially be used as a digital biomarker for the diagnosis of Parkinson's disease.
2105.07140
Zijin Gu
Zijin Gu, Keith W. Jamison, Meenakshi Khosla, Emily J. Allen, Yihan Wu, Thomas Naselaris, Kendrick Kay, Mert R. Sabuncu, Amy Kuceyeski
NeuroGen: activation optimized image synthesis for discovery neuroscience
null
null
null
null
q-bio.NC cs.CV q-bio.QM
http://creativecommons.org/licenses/by-nc-sa/4.0/
Functional MRI (fMRI) is a powerful technique that has allowed us to characterize visual cortex responses to stimuli, yet such experiments are by nature constructed based on a priori hypotheses, limited to the set of images presented to the individual while they are in the scanner, are subject to noise in the observed brain responses, and may vary widely across individuals. In this work, we propose a novel computational strategy, which we call NeuroGen, to overcome these limitations and develop a powerful tool for human vision neuroscience discovery. NeuroGen combines an fMRI-trained neural encoding model of human vision with a deep generative network to synthesize images predicted to achieve a target pattern of macro-scale brain activation. We demonstrate that the reduction of noise that the encoding model provides, coupled with the generative network's ability to produce images of high fidelity, results in a robust discovery architecture for visual neuroscience. By using only a small number of synthetic images created by NeuroGen, we demonstrate that we can detect and amplify differences in regional and individual human brain response patterns to visual stimuli. We then verify that these discoveries are reflected in the several thousand observed image responses measured with fMRI. We further demonstrate that NeuroGen can create synthetic images predicted to achieve regional response patterns not achievable by the best-matching natural images. The NeuroGen framework extends the utility of brain encoding models and opens up a new avenue for exploring, and possibly precisely controlling, the human visual system.
[ { "created": "Sat, 15 May 2021 04:36:39 GMT", "version": "v1" } ]
2021-05-18
[ [ "Gu", "Zijin", "" ], [ "Jamison", "Keith W.", "" ], [ "Khosla", "Meenakshi", "" ], [ "Allen", "Emily J.", "" ], [ "Wu", "Yihan", "" ], [ "Naselaris", "Thomas", "" ], [ "Kay", "Kendrick", "" ], [ "Sa...
Functional MRI (fMRI) is a powerful technique that has allowed us to characterize visual cortex responses to stimuli, yet such experiments are by nature constructed based on a priori hypotheses, limited to the set of images presented to the individual while they are in the scanner, are subject to noise in the observed brain responses, and may vary widely across individuals. In this work, we propose a novel computational strategy, which we call NeuroGen, to overcome these limitations and develop a powerful tool for human vision neuroscience discovery. NeuroGen combines an fMRI-trained neural encoding model of human vision with a deep generative network to synthesize images predicted to achieve a target pattern of macro-scale brain activation. We demonstrate that the reduction of noise that the encoding model provides, coupled with the generative network's ability to produce images of high fidelity, results in a robust discovery architecture for visual neuroscience. By using only a small number of synthetic images created by NeuroGen, we demonstrate that we can detect and amplify differences in regional and individual human brain response patterns to visual stimuli. We then verify that these discoveries are reflected in the several thousand observed image responses measured with fMRI. We further demonstrate that NeuroGen can create synthetic images predicted to achieve regional response patterns not achievable by the best-matching natural images. The NeuroGen framework extends the utility of brain encoding models and opens up a new avenue for exploring, and possibly precisely controlling, the human visual system.
2312.11179
Clara Horvath
Clara Horvath, Andreas K\"orner, Corinna Modiz
Data-based Model Identification of the Hypothalamus-Pituitary-Thyroid Complex
15 pages, 6 figures, included in abstract volume of the 11th EUROSIM Congress on Modelling and Simulation
null
null
null
q-bio.TO math.DS
http://creativecommons.org/licenses/by-nc-nd/4.0/
The thyroid gland, in conjunction with the pituitary and the hypothalamus, forms a regulated system due to their mutual influence through released hormones. The equilibrium point of this system, commonly referred to as the "set point", is individually determined. This means that determining the correct amount of medication to be administered to patients with hypothyroidism requires several treatment appointments creating an extended treatment process. Because the dynamics of the system have not yet been fully explored, mathematical models are needed to simulate the mutual influence of the respective hormones as well as their course over time. These models enable a deeper understanding of the functionality in the context of data measurements. Therefore, two existing time-dependent mathematical models are used and further analyzed to replicate this overall influence of disparate systems. Both are based on a system of two differential equations modelling the interacting hormones. The parameters of the two models are identified according to different calibration approaches by means of patient data collected in a retrospective study in collaboration with the Medical University of Vienna. The hormonal course in the time domain as well as equilibrium curves including the set-point are then simulated and analyzed with respect to the normalized mean squared error. These calibrated systems allow a more profound insight into the functionality of the formed complex.
[ { "created": "Mon, 18 Dec 2023 13:22:47 GMT", "version": "v1" } ]
2023-12-19
[ [ "Horvath", "Clara", "" ], [ "Körner", "Andreas", "" ], [ "Modiz", "Corinna", "" ] ]
The thyroid gland, in conjunction with the pituitary and the hypothalamus, forms a regulated system due to their mutual influence through released hormones. The equilibrium point of this system, commonly referred to as the "set point", is individually determined. This means that determining the correct amount of medication to be administered to patients with hypothyroidism requires several treatment appointments creating an extended treatment process. Because the dynamics of the system have not yet been fully explored, mathematical models are needed to simulate the mutual influence of the respective hormones as well as their course over time. These models enable a deeper understanding of the functionality in the context of data measurements. Therefore, two existing time-dependent mathematical models are used and further analyzed to replicate this overall influence of disparate systems. Both are based on a system of two differential equations modelling the interacting hormones. The parameters of the two models are identified according to different calibration approaches by means of patient data collected in a retrospective study in collaboration with the Medical University of Vienna. The hormonal course in the time domain as well as equilibrium curves including the set-point are then simulated and analyzed with respect to the normalized mean squared error. These calibrated systems allow a more profound insight into the functionality of the formed complex.
1602.00668
Ehsan Kazemi
Ehsan Kazemi and Matthias Grossglauser
On the Structure and Efficient Computation of IsoRank Node Similarities
8 pages and 1 figure
null
null
null
q-bio.MN cs.CE
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
The alignment of protein-protein interaction (PPI) networks has many applications, such as the detection of conserved biological network motifs, the prediction of protein interactions, and the reconstruction of phylogenetic trees [1, 2, 3]. IsoRank is one of the first global network alignment algorithms [4, 5, 6], where the goal is to match all (or most) of the nodes of two PPI networks. The IsoRank algorithm first computes a pairwise node similarity metric, and then generates a matching between the two node sets based on this metric. The metric is a convex combination of a structural similarity score (with weight $ \alpha $) and an extraneous amino-acid sequence similarity score for two proteins (with weight $ 1 - \alpha $). In this short paper, we make two contributions. First, we show that when IsoRank similarity depends only on network structure ($\alpha = 1$), the similarity of two nodes is only a function of their degrees. In other words, IsoRank similarity is invariant to any network rewiring that does not affect the node degrees. This result suggests a reason for the poor performance of IsoRank in structure-only ($ \alpha = 1 $) alignment. Second, using ideas from [7, 8], we develop an approximation algorithm that outperforms IsoRank (including recent versions with better scaling, e.g., [9]) by several orders of magnitude in time and memory complexity, despite only a negligible loss in precision.
[ { "created": "Mon, 1 Feb 2016 20:28:40 GMT", "version": "v1" }, { "created": "Wed, 24 Feb 2016 10:10:23 GMT", "version": "v2" } ]
2018-02-22
[ [ "Kazemi", "Ehsan", "" ], [ "Grossglauser", "Matthias", "" ] ]
The alignment of protein-protein interaction (PPI) networks has many applications, such as the detection of conserved biological network motifs, the prediction of protein interactions, and the reconstruction of phylogenetic trees [1, 2, 3]. IsoRank is one of the first global network alignment algorithms [4, 5, 6], where the goal is to match all (or most) of the nodes of two PPI networks. The IsoRank algorithm first computes a pairwise node similarity metric, and then generates a matching between the two node sets based on this metric. The metric is a convex combination of a structural similarity score (with weight $ \alpha $) and an extraneous amino-acid sequence similarity score for two proteins (with weight $ 1 - \alpha $). In this short paper, we make two contributions. First, we show that when IsoRank similarity depends only on network structure ($\alpha = 1$), the similarity of two nodes is only a function of their degrees. In other words, IsoRank similarity is invariant to any network rewiring that does not affect the node degrees. This result suggests a reason for the poor performance of IsoRank in structure-only ($ \alpha = 1 $) alignment. Second, using ideas from [7, 8], we develop an approximation algorithm that outperforms IsoRank (including recent versions with better scaling, e.g., [9]) by several orders of magnitude in time and memory complexity, despite only a negligible loss in precision.
1512.04562
Andrei Zakharov
D.A. Bratsun, D.V. Merkuriev, A.P. Zakharov, L.M. Pismen
Multiscale modelling of tumour growth induced by circadian rhythm disruption in epithelial tissue
Accepted to the Journal of Biological Physics
null
null
null
q-bio.CB nlin.AO
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
We propose a multiscale chemo-mechanical model of cancer tumour development in an epithelial tissue. The model is based on transformation of normal cells into the cancerous state triggered by a local failure of spatial synchronisation of the circadian rhythm. The model includes mechanical interactions and chemical signal exchange between neighbouring cells, as well as division of cells and intercalation, and allows for modification of the respective parameters following transformation into the cancerous state. The numerical simulations reproduce different dephasing patterns - spiral waves and quasistationary clustering, with the latter being conducive to cancer formation. Modification of mechanical properties reproduces distinct behaviour of invasive and localised carcinoma.
[ { "created": "Thu, 9 Jul 2015 22:36:31 GMT", "version": "v1" } ]
2015-12-16
[ [ "Bratsun", "D. A.", "" ], [ "Merkuriev", "D. V.", "" ], [ "Zakharov", "A. P.", "" ], [ "Pismen", "L. M.", "" ] ]
We propose a multiscale chemo-mechanical model of cancer tumour development in an epithelial tissue. The model is based on transformation of normal cells into the cancerous state triggered by a local failure of spatial synchronisation of the circadian rhythm. The model includes mechanical interactions and chemical signal exchange between neighbouring cells, as well as division of cells and intercalation, and allows for modification of the respective parameters following transformation into the cancerous state. The numerical simulations reproduce different dephasing patterns - spiral waves and quasistationary clustering, with the latter being conducive to cancer formation. Modification of mechanical properties reproduces distinct behaviour of invasive and localised carcinoma.
0802.1570
Mark McDonnell
Mark D. McDonnell and Nigel G. Stocks
Maximally Informative Stimuli and Tuning Curves for Sigmoidal Rate-Coding Neurons and Populations
Accepted by Physical Review Letters. This revision updates figures and text
Physical Review Letters 101, 058103, 2008
10.1103/PhysRevLett.101.058103
null
q-bio.NC
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
A general method for deriving maximally informative sigmoidal tuning curves for neural systems with small normalized variability is presented. The optimal tuning curve is a nonlinear function of the cumulative distribution function of the stimulus and depends on the mean-variance relationship of the neural system. The derivation is based on a known relationship between Shannon's mutual information and Fisher information, and the optimality of Jeffrey's prior. It relies on the existence of closed-form solutions to the converse problem of optimizing the stimulus distribution for a given tuning curve. It is shown that maximum mutual information corresponds to constant Fisher information only if the stimulus is uniformly distributed. As an example, the case of sub-Poisson binomial firing statistics is analyzed in detail.
[ { "created": "Tue, 12 Feb 2008 06:32:48 GMT", "version": "v1" }, { "created": "Thu, 15 May 2008 00:47:03 GMT", "version": "v2" }, { "created": "Fri, 4 Jul 2008 01:13:59 GMT", "version": "v3" } ]
2008-08-02
[ [ "McDonnell", "Mark D.", "" ], [ "Stocks", "Nigel G.", "" ] ]
A general method for deriving maximally informative sigmoidal tuning curves for neural systems with small normalized variability is presented. The optimal tuning curve is a nonlinear function of the cumulative distribution function of the stimulus and depends on the mean-variance relationship of the neural system. The derivation is based on a known relationship between Shannon's mutual information and Fisher information, and the optimality of Jeffrey's prior. It relies on the existence of closed-form solutions to the converse problem of optimizing the stimulus distribution for a given tuning curve. It is shown that maximum mutual information corresponds to constant Fisher information only if the stimulus is uniformly distributed. As an example, the case of sub-Poisson binomial firing statistics is analyzed in detail.
2005.10227
Marcio Dorn
Eduardo Avila, Marcio Dorn, Clarice Sampaio Alho, Alessandro Kahmann
Hemogram Data as a Tool for Decision-making in COVID-19 Management: Applications to Resource Scarcity Scenarios
14 pages, 5 figures, 2 tables, Tool Available at: http://sbcb.inf.ufrgs.br/covid
null
null
null
q-bio.OT cs.LG
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
COVID-19 pandemics has challenged emergency response systems worldwide, with widespread reports of essential services breakdown and collapse of health care structure. A critical element involves essential workforce management since current protocols recommend release from duty for symptomatic individuals, including essential personnel. Testing capacity is also problematic in several countries, where diagnosis demand outnumbers available local testing capacity. This work describes a machine learning model derived from hemogram exam data performed in symptomatic patients and how they can be used to predict qRT-PCR test results. Methods: A Naive-Bayes model for machine learning is proposed for handling different scarcity scenarios, including managing symptomatic essential workforce and absence of diagnostic tests. Hemogram result data was used to predict qRT-PCR results in situations where the latter was not performed, or results are not yet available. Adjusts in assumed prior probabilities allow fine-tuning of the model, according to actual prediction context. Proposed models can predict COVID-19 qRT-PCR results in symptomatic individuals with high accuracy, sensitivity and specificity. Data assessment can be performed in an individual or simultaneous basis, according to desired outcome. Based on hemogram data and background scarcity context, resource distribution is significantly optimized when model-based patient selection is observed, compared to random choice. The model can help manage testing deficiency and other critical circumstances. Machine learning models can be derived from widely available, quick, and inexpensive exam data in order to predict qRT-PCR results used in COVID-19 diagnosis. These models can be used to assist strategic decision-making in resource scarcity scenarios, including personnel shortage, lack of medical resources, and testing insufficiency.
[ { "created": "Sun, 10 May 2020 01:45:03 GMT", "version": "v1" } ]
2020-05-21
[ [ "Avila", "Eduardo", "" ], [ "Dorn", "Marcio", "" ], [ "Alho", "Clarice Sampaio", "" ], [ "Kahmann", "Alessandro", "" ] ]
COVID-19 pandemics has challenged emergency response systems worldwide, with widespread reports of essential services breakdown and collapse of health care structure. A critical element involves essential workforce management since current protocols recommend release from duty for symptomatic individuals, including essential personnel. Testing capacity is also problematic in several countries, where diagnosis demand outnumbers available local testing capacity. This work describes a machine learning model derived from hemogram exam data performed in symptomatic patients and how they can be used to predict qRT-PCR test results. Methods: A Naive-Bayes model for machine learning is proposed for handling different scarcity scenarios, including managing symptomatic essential workforce and absence of diagnostic tests. Hemogram result data was used to predict qRT-PCR results in situations where the latter was not performed, or results are not yet available. Adjusts in assumed prior probabilities allow fine-tuning of the model, according to actual prediction context. Proposed models can predict COVID-19 qRT-PCR results in symptomatic individuals with high accuracy, sensitivity and specificity. Data assessment can be performed in an individual or simultaneous basis, according to desired outcome. Based on hemogram data and background scarcity context, resource distribution is significantly optimized when model-based patient selection is observed, compared to random choice. The model can help manage testing deficiency and other critical circumstances. Machine learning models can be derived from widely available, quick, and inexpensive exam data in order to predict qRT-PCR results used in COVID-19 diagnosis. These models can be used to assist strategic decision-making in resource scarcity scenarios, including personnel shortage, lack of medical resources, and testing insufficiency.
2403.02706
Hyeongwoo Kim
Hyeongwoo Kim, Seokhyun Moon, Wonho Zhung, Jaechang Lim, and Woo Youn Kim
DeepBioisostere: Discovering Bioisosteres with Deep Learning for a Fine Control of Multiple Molecular Properties
32 pages, 7 figures, and 2 tables for main text
null
null
null
q-bio.BM
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
Optimizing molecules to improve their properties is a fundamental challenge in drug design. For a fine-tuning of molecular properties without losing bio-activity validated in advance, the concept of bioisosterism has emerged. Many in silico methods have been proposed for discovering bioisosteres, but they require expert knowledge for their applications or are restricted to known databases. Here, we introduce DeepBioisostere, a deep generative model to design suitable bioisosteric replacements. Our model allows an end-to-end chemical replacement by intelligently selecting fragments for removal and insertion along with their attachment orientation. Through various scenarios of multiple property control, we showcase the model's capability to modulate specific properties, addressing the challenge in molecular optimization. Our model's innovation lies in its capacity to design a bioisosteric replacement reflecting the compatibility with the surroundings of the modification site, facilitating the control of sophisticated properties like drug-likeness. DeepBioisostere can also provide previously unseen bioisosteric replacements, highlighting its capability for exploring diverse chemical modifications rather than just mining them from known databases. Lastly, we employed DeepBioisostere to improve the sensitivity of a known SARS-CoV-2 main protease inhibitor to the E166V mutant that exhibits drug resistance to the inhibitor, demonstrating its potential application in lead optimization.
[ { "created": "Tue, 5 Mar 2024 06:55:43 GMT", "version": "v1" } ]
2024-03-06
[ [ "Kim", "Hyeongwoo", "" ], [ "Moon", "Seokhyun", "" ], [ "Zhung", "Wonho", "" ], [ "Lim", "Jaechang", "" ], [ "Kim", "Woo Youn", "" ] ]
Optimizing molecules to improve their properties is a fundamental challenge in drug design. For a fine-tuning of molecular properties without losing bio-activity validated in advance, the concept of bioisosterism has emerged. Many in silico methods have been proposed for discovering bioisosteres, but they require expert knowledge for their applications or are restricted to known databases. Here, we introduce DeepBioisostere, a deep generative model to design suitable bioisosteric replacements. Our model allows an end-to-end chemical replacement by intelligently selecting fragments for removal and insertion along with their attachment orientation. Through various scenarios of multiple property control, we showcase the model's capability to modulate specific properties, addressing the challenge in molecular optimization. Our model's innovation lies in its capacity to design a bioisosteric replacement reflecting the compatibility with the surroundings of the modification site, facilitating the control of sophisticated properties like drug-likeness. DeepBioisostere can also provide previously unseen bioisosteric replacements, highlighting its capability for exploring diverse chemical modifications rather than just mining them from known databases. Lastly, we employed DeepBioisostere to improve the sensitivity of a known SARS-CoV-2 main protease inhibitor to the E166V mutant that exhibits drug resistance to the inhibitor, demonstrating its potential application in lead optimization.
1002.4386
Narayanan Viswanath Chulliparambil
Viswanath C Narayanan
About the Number of Base Substitutions Between Humans and Common Chimpanzees
7 pages
null
null
null
q-bio.PE
http://creativecommons.org/licenses/by/3.0/
Humans and chimpanzees are believed to have shared a common ancestor about 6 million years ago. Here using a new distance measure called the Jump distance, we calculate the number of base substitutions that might have occurred in the mitochondrial DNA during these 6 million years.
[ { "created": "Tue, 23 Feb 2010 18:19:32 GMT", "version": "v1" } ]
2010-02-24
[ [ "Narayanan", "Viswanath C", "" ] ]
Humans and chimpanzees are believed to have shared a common ancestor about 6 million years ago. Here using a new distance measure called the Jump distance, we calculate the number of base substitutions that might have occurred in the mitochondrial DNA during these 6 million years.
1901.07212
Oksana Gorobets Prof.
Svitlana Gorobets, Oksana Gorobets, Alona Magerman, Yuri Gorobets, Iryna Sharay
Biogenic magnetic nanoparticles in plants
16 pages, 4 figures, 5 tables
null
null
null
q-bio.OT
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
The genetic programming of biosynthesis of biogenic magnetic nanoparticles (BMNs) in plants was revealed by methods of comparative genomics. The samples of leaves and the root of Nicotiana tabacum, the stems and tubers of Solanum tuberosum and the stems of pea Pisum sativum were examined by scanning probe microscopy (in atomic force and magnetic power modes), and it was found that the BMNs are located in the form of chains in the wall of the phloem sieve tubes (ie, the vascular tissue of plants). Such a localization of BMNs supports the idea that the chains of BMNs in different organs of plants have common metabolic functions. Stray gradient magnetic fields about several thousand Oe, which are created by chains of BMNs, can significantly affect the processes of mass transfer near the membrane of vesicles, granules, organelles, structural elements of the membrane, and others. This process is enhanced in plants when artificial magnetite is added to the soil.
[ { "created": "Tue, 22 Jan 2019 08:56:19 GMT", "version": "v1" } ]
2019-01-23
[ [ "Gorobets", "Svitlana", "" ], [ "Gorobets", "Oksana", "" ], [ "Magerman", "Alona", "" ], [ "Gorobets", "Yuri", "" ], [ "Sharay", "Iryna", "" ] ]
The genetic programming of biosynthesis of biogenic magnetic nanoparticles (BMNs) in plants was revealed by methods of comparative genomics. The samples of leaves and the root of Nicotiana tabacum, the stems and tubers of Solanum tuberosum and the stems of pea Pisum sativum were examined by scanning probe microscopy (in atomic force and magnetic power modes), and it was found that the BMNs are located in the form of chains in the wall of the phloem sieve tubes (ie, the vascular tissue of plants). Such a localization of BMNs supports the idea that the chains of BMNs in different organs of plants have common metabolic functions. Stray gradient magnetic fields about several thousand Oe, which are created by chains of BMNs, can significantly affect the processes of mass transfer near the membrane of vesicles, granules, organelles, structural elements of the membrane, and others. This process is enhanced in plants when artificial magnetite is added to the soil.
0706.3137
Emma Jin
Emma Y. Jin and Christian M. Reidys
Asymptotic Enumeration of RNA Structures with Pseudoknots
22 pages, 7 figures
null
null
null
q-bio.BM math.CO
null
In this paper we present the asymptotic enumeration of RNA structures with pseudoknots. We develop a general framework for the computation of exponential growth rate and the sub exponential factors for $k$-noncrossing RNA structures. Our results are based on the generating function for the number of $k$-noncrossing RNA pseudoknot structures, ${\sf S}_k(n)$, derived in \cite{Reidys:07pseu}, where $k-1$ denotes the maximal size of sets of mutually intersecting bonds. We prove a functional equation for the generating function $\sum_{n\ge 0}{\sf S}_k(n)z^n$ and obtain for $k=2$ and $k=3$ the analytic continuation and singular expansions, respectively. It is implicit in our results that for arbitrary $k$ singular expansions exist and via transfer theorems of analytic combinatorics we obtain asymptotic expression for the coefficients. We explicitly derive the asymptotic expressions for 2- and 3-noncrossing RNA structures. Our main result is the derivation of the formula ${\sf S}_3(n) \sim \frac{10.4724\cdot 4!}{n(n-1)...(n-4)} (\frac{5+\sqrt{21}}{2})^n$.
[ { "created": "Thu, 21 Jun 2007 12:31:34 GMT", "version": "v1" } ]
2009-09-29
[ [ "Jin", "Emma Y.", "" ], [ "Reidys", "Christian M.", "" ] ]
In this paper we present the asymptotic enumeration of RNA structures with pseudoknots. We develop a general framework for the computation of exponential growth rate and the sub exponential factors for $k$-noncrossing RNA structures. Our results are based on the generating function for the number of $k$-noncrossing RNA pseudoknot structures, ${\sf S}_k(n)$, derived in \cite{Reidys:07pseu}, where $k-1$ denotes the maximal size of sets of mutually intersecting bonds. We prove a functional equation for the generating function $\sum_{n\ge 0}{\sf S}_k(n)z^n$ and obtain for $k=2$ and $k=3$ the analytic continuation and singular expansions, respectively. It is implicit in our results that for arbitrary $k$ singular expansions exist and via transfer theorems of analytic combinatorics we obtain asymptotic expression for the coefficients. We explicitly derive the asymptotic expressions for 2- and 3-noncrossing RNA structures. Our main result is the derivation of the formula ${\sf S}_3(n) \sim \frac{10.4724\cdot 4!}{n(n-1)...(n-4)} (\frac{5+\sqrt{21}}{2})^n$.
q-bio/0604035
Rui Dilao
Rui Dilao and Abdelkader Lakmeche
On the weak solutions of the McKendrick equation: Existence of demography cycles
26 pages, 6 figures
null
null
null
q-bio.PE
null
We develop the qualitative theory of the solutions of the McKendrick partial differential equation of population dynamics. We calculate explicitly the weak solutions of the McKendrick equation and of the Lotka renewal integral equation with time and age dependent birth rate. Mortality modulus is considered age dependent. We show the existence of demography cycles. For a population with only one reproductive age class, independently of the stability of the weak solutions and after a transient time, the temporal evolution of the number of individuals of a population is always modulated by a time periodic function. The periodicity of the cycles is equal to the age of the reproductive age class, and a population retains the memory from the initial data through the amplitude of oscillations. For a population with a continuous distribution of reproductive age classes, the amplitude of oscillation is damped. The periodicity of the damped cycles is associated with the age of the first reproductive age class. Damping increases as the dispersion of the fertility function around the age class with maximal fertility increases. In general, the period of the demography cycles is associated with the time that a species takes to reach the reproductive maturity.
[ { "created": "Thu, 27 Apr 2006 18:50:30 GMT", "version": "v1" }, { "created": "Thu, 7 Sep 2006 12:46:26 GMT", "version": "v2" } ]
2007-05-23
[ [ "Dilao", "Rui", "" ], [ "Lakmeche", "Abdelkader", "" ] ]
We develop the qualitative theory of the solutions of the McKendrick partial differential equation of population dynamics. We calculate explicitly the weak solutions of the McKendrick equation and of the Lotka renewal integral equation with time and age dependent birth rate. Mortality modulus is considered age dependent. We show the existence of demography cycles. For a population with only one reproductive age class, independently of the stability of the weak solutions and after a transient time, the temporal evolution of the number of individuals of a population is always modulated by a time periodic function. The periodicity of the cycles is equal to the age of the reproductive age class, and a population retains the memory from the initial data through the amplitude of oscillations. For a population with a continuous distribution of reproductive age classes, the amplitude of oscillation is damped. The periodicity of the damped cycles is associated with the age of the first reproductive age class. Damping increases as the dispersion of the fertility function around the age class with maximal fertility increases. In general, the period of the demography cycles is associated with the time that a species takes to reach the reproductive maturity.
1111.1152
Tim Rogers
Tim Rogers, Alan J. McKane and Axel G. Rossberg
Demographic noise can lead to the spontaneous formation of species
null
Europhys. Lett. (2012) 97, 40008
10.1209/0295-5075/97/40008
null
q-bio.PE cond-mat.stat-mech physics.bio-ph
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
When a collection of phenotypically diverse organisms compete with each other for limited resources, with competition being strongest amongst the most similar, the population can evolve into tightly localised clusters. This process can be thought of as a simple model of the emergence of species. Past studies have neglected the effects of demographic noise and studied the population on a macroscopic scale, where species formation is found to depend upon the shape of the curve describing the decline of competition strength with phenotypic distance. In the following, we will show how including the effects of demographic noise leads to a radically different conclusion. Two situations are identified: a weak-noise regime in which the population exhibits patterns of fluctuation around the macroscopic description, and a strong-noise regime where species appear spontaneously even in the case that all organisms have equal fitness.
[ { "created": "Fri, 4 Nov 2011 15:24:35 GMT", "version": "v1" }, { "created": "Tue, 15 May 2012 09:26:29 GMT", "version": "v2" } ]
2012-05-16
[ [ "Rogers", "Tim", "" ], [ "McKane", "Alan J.", "" ], [ "Rossberg", "Axel G.", "" ] ]
When a collection of phenotypically diverse organisms compete with each other for limited resources, with competition being strongest amongst the most similar, the population can evolve into tightly localised clusters. This process can be thought of as a simple model of the emergence of species. Past studies have neglected the effects of demographic noise and studied the population on a macroscopic scale, where species formation is found to depend upon the shape of the curve describing the decline of competition strength with phenotypic distance. In the following, we will show how including the effects of demographic noise leads to a radically different conclusion. Two situations are identified: a weak-noise regime in which the population exhibits patterns of fluctuation around the macroscopic description, and a strong-noise regime where species appear spontaneously even in the case that all organisms have equal fitness.
2208.04720
Richard Tj\"ornhammar
Richard Tj\"ornhammar
Clustering Optimisation Method for Highly Connected Biological Data
null
null
null
null
q-bio.QM cs.LG
http://creativecommons.org/licenses/by/4.0/
Currently, data-driven discovery in biological sciences resides in finding segmentation strategies in multivariate data that produce sensible descriptions of the data. Clustering is but one of several approaches and sometimes falls short because of difficulties in assessing reasonable cutoffs, the number of clusters that need to be formed or that an approach fails to preserve topological properties of the original system in its clustered form. In this work, we show how a simple metric for connectivity clustering evaluation leads to an optimised segmentation of biological data. The novelty of the work resides in the creation of a simple optimisation method for clustering crowded data. The resulting clustering approach only relies on metrics derived from the inherent properties of the clustering. The new method facilitates knowledge for optimised clustering, which is easy to implement. We discuss how the clustering optimisation strategy corresponds to the viable information content yielded by the final segmentation. We further elaborate on how the clustering results, in the optimal solution, corresponds to prior knowledge of three different data sets.
[ { "created": "Mon, 8 Aug 2022 17:33:32 GMT", "version": "v1" }, { "created": "Thu, 11 Aug 2022 17:41:20 GMT", "version": "v2" } ]
2022-08-12
[ [ "Tjörnhammar", "Richard", "" ] ]
Currently, data-driven discovery in biological sciences resides in finding segmentation strategies in multivariate data that produce sensible descriptions of the data. Clustering is but one of several approaches and sometimes falls short because of difficulties in assessing reasonable cutoffs, the number of clusters that need to be formed or that an approach fails to preserve topological properties of the original system in its clustered form. In this work, we show how a simple metric for connectivity clustering evaluation leads to an optimised segmentation of biological data. The novelty of the work resides in the creation of a simple optimisation method for clustering crowded data. The resulting clustering approach only relies on metrics derived from the inherent properties of the clustering. The new method facilitates knowledge for optimised clustering, which is easy to implement. We discuss how the clustering optimisation strategy corresponds to the viable information content yielded by the final segmentation. We further elaborate on how the clustering results, in the optimal solution, corresponds to prior knowledge of three different data sets.
q-bio/0502031
Julien Mayor
Julien Mayor and Wulfram Gerstner
Signal buffering in random networks of spiking neurons: microscopic vs. macroscopic phenomena
5 pages, 3 figures
null
10.1103/PhysRevE.72.051906
null
q-bio.NC
null
In randomly connected networks of pulse-coupled elements a time-dependent input signal can be buffered over a short time. We studied the signal buffering properties in simulated networks as a function of the networks state, characterized by both the Lyapunov exponent of the microscopic dynamics and the macroscopic activity derived from mean-field theory. If all network elements receive the same signal, signal buffering over delays comparable to the intrinsic time constant of the network elements can be explained by macroscopic properties and works best at the phase transition to chaos. However, if only 20 percent of the network units receive a common time-dependent signal, signal buffering properties improve and can no longer be attributed to the macroscopic dynamics.
[ { "created": "Wed, 23 Feb 2005 10:23:04 GMT", "version": "v1" } ]
2009-11-11
[ [ "Mayor", "Julien", "" ], [ "Gerstner", "Wulfram", "" ] ]
In randomly connected networks of pulse-coupled elements a time-dependent input signal can be buffered over a short time. We studied the signal buffering properties in simulated networks as a function of the networks state, characterized by both the Lyapunov exponent of the microscopic dynamics and the macroscopic activity derived from mean-field theory. If all network elements receive the same signal, signal buffering over delays comparable to the intrinsic time constant of the network elements can be explained by macroscopic properties and works best at the phase transition to chaos. However, if only 20 percent of the network units receive a common time-dependent signal, signal buffering properties improve and can no longer be attributed to the macroscopic dynamics.
1406.1537
Sungwoo Ahn
Leonid L Rubchinsky, Sungwoo Ahn, and Choongseok Park
Dynamics of desynchronized episodes in intermittent synchronization
12 pages, 2 figures. Accepted to Frontiers in Physics
Front. Phys. 2:38, 2014
10.3389/fphy.2014.00038
null
q-bio.NC
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
Intermittent synchronization is observed in a variety of different experimental settings in physics and beyond and is an established research topic in nonlinear dynamics. When coupled oscillators exhibit relatively weak, intermittent synchrony, the trajectory in the phase space spends a substantial fraction of time away from a vicinity of a synchronized state. Thus to describe and understand the observed dynamics one may consider both synchronized episodes and desynchronized episodes (the episodes when oscillators are not synchronous). This mini-review discusses recent developments in this area. We explain how one can consider variation in synchrony on the very short time-scales, provided that there is some degree of overall synchrony. We show how to implement this approach in the case of intermittent phase locking, review several recent examples of the application of these ideas to experimental data and modeling systems, and discuss when and why these methods may be useful.
[ { "created": "Thu, 5 Jun 2014 22:20:25 GMT", "version": "v1" } ]
2021-04-26
[ [ "Rubchinsky", "Leonid L", "" ], [ "Ahn", "Sungwoo", "" ], [ "Park", "Choongseok", "" ] ]
Intermittent synchronization is observed in a variety of different experimental settings in physics and beyond and is an established research topic in nonlinear dynamics. When coupled oscillators exhibit relatively weak, intermittent synchrony, the trajectory in the phase space spends a substantial fraction of time away from a vicinity of a synchronized state. Thus to describe and understand the observed dynamics one may consider both synchronized episodes and desynchronized episodes (the episodes when oscillators are not synchronous). This mini-review discusses recent developments in this area. We explain how one can consider variation in synchrony on the very short time-scales, provided that there is some degree of overall synchrony. We show how to implement this approach in the case of intermittent phase locking, review several recent examples of the application of these ideas to experimental data and modeling systems, and discuss when and why these methods may be useful.
0902.1477
Mehmet Erbudak
Mehmet Erbudak and Ayse Erzan
Tracking tumor evolution via the prostate marker PSA: An individual post-operative study
9 pages, two figures
null
null
null
q-bio.QM q-bio.TO
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
The progress of the prostate-specific antigen after radical prostatectomy is observed for a patient in order to extract information on the growth mode of the tumor cells. An initial fast-growth mode goes over to a slower power-law regime within two years of surgery. We argue that such studies may help determine the appropriate time window for subsequent therapies in order to increase the life expectancy of the patient.
[ { "created": "Mon, 9 Feb 2009 17:04:10 GMT", "version": "v1" } ]
2009-02-10
[ [ "Erbudak", "Mehmet", "" ], [ "Erzan", "Ayse", "" ] ]
The progress of the prostate-specific antigen after radical prostatectomy is observed for a patient in order to extract information on the growth mode of the tumor cells. An initial fast-growth mode goes over to a slower power-law regime within two years of surgery. We argue that such studies may help determine the appropriate time window for subsequent therapies in order to increase the life expectancy of the patient.
q-bio/0609037
Y.-H. Taguchi
Y-h. Taguchi, M. Michael Gromiha
Comparison of amino acid occurrence and composition for predicting protein folds
null
null
null
IPSJ SIG Technical Report 2007-BIO-008 (2007) 9-16
q-bio.BM cond-mat.soft nlin.AO q-bio.QM
null
Background:Prediction of protein three-dimensional structures from amino acid sequences is a long-standing goal in computational/molecular biology. The successful discrimination of protein folds would help to improve the accuracy of protein 3D structure prediction. Results: In this work, we propose a method based on linear discriminant analysis (LDA) for recognizing proteins belonging to 30 different folds using the occurrence of amino acid residues in a set of 1612 proteins. The present method could discriminate the globular proteins from 30 major folding types with the sensitivity of 37%, which is comparable to or better than other methods in the literature. A web server has been developed for predicting the folding type of the protein from amino acid sequence and it is available at http://granular.com/PROLDA/. Conclusions:Linear discriminant analysis based on amino acid occurrence could successfully recognize protein folds. The present method has several advantages such as, (i) it directly predicts the folding type of a protein without performing pair-wise comparisons, (ii) it can discriminate folds among large number of proteins and (iii) it is very fast to obtain the results. This is a simple method, which can be easily incorporated in any other structure prediction algorithms.
[ { "created": "Mon, 25 Sep 2006 02:14:44 GMT", "version": "v1" }, { "created": "Fri, 19 Jan 2007 09:05:13 GMT", "version": "v2" }, { "created": "Thu, 10 May 2007 08:00:04 GMT", "version": "v3" } ]
2007-05-23
[ [ "Taguchi", "Y-h.", "" ], [ "Gromiha", "M. Michael", "" ] ]
Background:Prediction of protein three-dimensional structures from amino acid sequences is a long-standing goal in computational/molecular biology. The successful discrimination of protein folds would help to improve the accuracy of protein 3D structure prediction. Results: In this work, we propose a method based on linear discriminant analysis (LDA) for recognizing proteins belonging to 30 different folds using the occurrence of amino acid residues in a set of 1612 proteins. The present method could discriminate the globular proteins from 30 major folding types with the sensitivity of 37%, which is comparable to or better than other methods in the literature. A web server has been developed for predicting the folding type of the protein from amino acid sequence and it is available at http://granular.com/PROLDA/. Conclusions:Linear discriminant analysis based on amino acid occurrence could successfully recognize protein folds. The present method has several advantages such as, (i) it directly predicts the folding type of a protein without performing pair-wise comparisons, (ii) it can discriminate folds among large number of proteins and (iii) it is very fast to obtain the results. This is a simple method, which can be easily incorporated in any other structure prediction algorithms.
2205.08734
Chika Koyama
Chika Koyama
Brain waves are a repetition of a pause and an activity
26 pages, 6 figures, 6 supplementary figures
null
null
null
q-bio.NC
http://creativecommons.org/licenses/by-sa/4.0/
Brain waves still cannot reliably distinguish between awake and asleep states. Here, I present new original indices, voltage subthreshold wave {\tau} and abovethreshold wave burst, for advanced LFP/EEG readings. Assuming that {\tau} is a microwave that fluctuates every sample such as the equipotential, the total number of {\tau} (N{\tau}) is inferred to be the maximum, and the amplitude of burst (Abst) is inferred to be the minimum. In fact, they invariably had a mean {\tau} duration (M{\tau}) of 2-3 sample intervals in any case. In addition, {\tau} and burst exhibited self-similarity for sample frequency while occupying approximately 30% and 70% of LFP in the natural state, respectively. Its threshold and Abst were correlated with the vigilance state and decreased to 70% by doubling the sample frequency. The dose of sevoflurane, which inhibits and synchronizes neural activity, was linearly correlated with decreases in the threshold and N{\tau}. Thus, {\tau} could reflect the uncertainty of the membrane potential. I propose that {\tau} and burst represent a pause and an activity such as the rhythm of the brain.
[ { "created": "Wed, 18 May 2022 05:54:15 GMT", "version": "v1" }, { "created": "Wed, 29 Jun 2022 12:09:10 GMT", "version": "v2" }, { "created": "Wed, 3 Jul 2024 12:04:52 GMT", "version": "v3" } ]
2024-07-04
[ [ "Koyama", "Chika", "" ] ]
Brain waves still cannot reliably distinguish between awake and asleep states. Here, I present new original indices, voltage subthreshold wave {\tau} and abovethreshold wave burst, for advanced LFP/EEG readings. Assuming that {\tau} is a microwave that fluctuates every sample such as the equipotential, the total number of {\tau} (N{\tau}) is inferred to be the maximum, and the amplitude of burst (Abst) is inferred to be the minimum. In fact, they invariably had a mean {\tau} duration (M{\tau}) of 2-3 sample intervals in any case. In addition, {\tau} and burst exhibited self-similarity for sample frequency while occupying approximately 30% and 70% of LFP in the natural state, respectively. Its threshold and Abst were correlated with the vigilance state and decreased to 70% by doubling the sample frequency. The dose of sevoflurane, which inhibits and synchronizes neural activity, was linearly correlated with decreases in the threshold and N{\tau}. Thus, {\tau} could reflect the uncertainty of the membrane potential. I propose that {\tau} and burst represent a pause and an activity such as the rhythm of the brain.
1312.4875
William Gray Roncal
William Gray Roncal, Zachary H. Koterba, Disa Mhembere, Dean M. Kleissas, Joshua T. Vogelstein, Randal Burns, Anita R. Bowles, Dimitrios K. Donavos, Sephira Ryman, Rex E. Jung, Lei Wu, Vince Calhoun, and R. Jacob Vogelstein
MIGRAINE: MRI Graph Reliability Analysis and Inference for Connectomics
Published as part of 2013 IEEE GlobalSIP conference
null
10.1109/GlobalSIP.2013.6736878
null
q-bio.QM cs.CE
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
Currently, connectomes (e.g., functional or structural brain graphs) can be estimated in humans at $\approx 1~mm^3$ scale using a combination of diffusion weighted magnetic resonance imaging, functional magnetic resonance imaging and structural magnetic resonance imaging scans. This manuscript summarizes a novel, scalable implementation of open-source algorithms to rapidly estimate magnetic resonance connectomes, using both anatomical regions of interest (ROIs) and voxel-size vertices. To assess the reliability of our pipeline, we develop a novel nonparametric non-Euclidean reliability metric. Here we provide an overview of the methods used, demonstrate our implementation, and discuss available user extensions. We conclude with results showing the efficacy and reliability of the pipeline over previous state-of-the-art.
[ { "created": "Tue, 17 Dec 2013 17:39:45 GMT", "version": "v1" } ]
2016-11-17
[ [ "Roncal", "William Gray", "" ], [ "Koterba", "Zachary H.", "" ], [ "Mhembere", "Disa", "" ], [ "Kleissas", "Dean M.", "" ], [ "Vogelstein", "Joshua T.", "" ], [ "Burns", "Randal", "" ], [ "Bowles", "Anita R.", ...
Currently, connectomes (e.g., functional or structural brain graphs) can be estimated in humans at $\approx 1~mm^3$ scale using a combination of diffusion weighted magnetic resonance imaging, functional magnetic resonance imaging and structural magnetic resonance imaging scans. This manuscript summarizes a novel, scalable implementation of open-source algorithms to rapidly estimate magnetic resonance connectomes, using both anatomical regions of interest (ROIs) and voxel-size vertices. To assess the reliability of our pipeline, we develop a novel nonparametric non-Euclidean reliability metric. Here we provide an overview of the methods used, demonstrate our implementation, and discuss available user extensions. We conclude with results showing the efficacy and reliability of the pipeline over previous state-of-the-art.
2002.01299
Val\'erie Gabelica
Steven Daly, Frederic Rosu, Valerie Gabelica
Mass-Resolved Electronic Circular Dichroism Ion Spectroscopy
main text (7 pages, 2 figures) + supporting information (20 pages, 11 figures)
null
10.1126/science.abb1822
null
q-bio.BM physics.bio-ph
http://creativecommons.org/licenses/by-nc-sa/4.0/
DNA and proteins are chiral: their three-dimensional structure cannot be superimposed with its mirror image. Circular dichroism spectroscopy is widely used to characterize chiral compounds, but data interpretation is difficult in the case of mixtures. We recorded for the first time the electronic circular dichroism spectra of DNA helices separated in a mass spectrometer. We electrosprayed guanine-rich strands having various secondary structures as negative ions, irradiated them with a laser, and measured the difference in electron photodetachment efficiency between left and right circularly polarized light. The reconstructed circular dichroism ion spectra resemble the solution ones, thereby allowing us to assign the DNA helical topology. The ability to measure circular dichroism directly on biomolecular ions expands the capabilities of mass spectrometry for structural analysis.
[ { "created": "Tue, 4 Feb 2020 14:26:34 GMT", "version": "v1" } ]
2020-09-09
[ [ "Daly", "Steven", "" ], [ "Rosu", "Frederic", "" ], [ "Gabelica", "Valerie", "" ] ]
DNA and proteins are chiral: their three-dimensional structure cannot be superimposed with its mirror image. Circular dichroism spectroscopy is widely used to characterize chiral compounds, but data interpretation is difficult in the case of mixtures. We recorded for the first time the electronic circular dichroism spectra of DNA helices separated in a mass spectrometer. We electrosprayed guanine-rich strands having various secondary structures as negative ions, irradiated them with a laser, and measured the difference in electron photodetachment efficiency between left and right circularly polarized light. The reconstructed circular dichroism ion spectra resemble the solution ones, thereby allowing us to assign the DNA helical topology. The ability to measure circular dichroism directly on biomolecular ions expands the capabilities of mass spectrometry for structural analysis.
1711.07383
Ramon Grima
Abhyudai Singh and Ramon Grima
The Linear-Noise Approximation and moment-closure approximations for stochastic chemical kinetics
24 pages, 4 figures. To be published as a chapter in the book "Quantitative Biology: Theory, Computational Methods and Examples of Models" edited by Brian Munsky, Lev Tsimring and Bill Hlavack (MIT Press)
null
null
null
q-bio.SC
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
This is a short review of two common approximations in stochastic chemical and biochemical kinetics. It will appear as Chapter 6 in the book "Quantitative Biology: Theory, Computational Methods and Examples of Models" edited by Brian Munsky, Lev Tsimring and Bill Hlavacek (to be published in late 2017/2018 by MIT Press). All chapter references in this article refer to chapters in the aforementioned book.
[ { "created": "Mon, 20 Nov 2017 15:41:51 GMT", "version": "v1" }, { "created": "Fri, 24 Nov 2017 15:10:54 GMT", "version": "v2" } ]
2017-11-27
[ [ "Singh", "Abhyudai", "" ], [ "Grima", "Ramon", "" ] ]
This is a short review of two common approximations in stochastic chemical and biochemical kinetics. It will appear as Chapter 6 in the book "Quantitative Biology: Theory, Computational Methods and Examples of Models" edited by Brian Munsky, Lev Tsimring and Bill Hlavacek (to be published in late 2017/2018 by MIT Press). All chapter references in this article refer to chapters in the aforementioned book.
1308.2150
Cameron Palmer
Cameron Palmer and Itsik Pe'er
GeneZip: A software package for storage-efficient processing of genotype data
6 pages, 1 figure Stylistic edits, added references, added author who joined project between versions; conclusions unchanged
null
null
null
q-bio.QM q-bio.GN
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
Genome wide association studies directly assay 10^6 single nucleotide polymorphisms (SNPs) across a study cohort. Probabilistic estimation of additional sites by genotype imputation can increase this set of variants by 10- to 40-fold. Even with modest sample sizes (10^3-10^4), these resulting imputed datasets, containing 10^10-10^11 double-precision values, are incompatible with simultaneous lossless storage in RAM using standard methods. Existing solutions for this problem require compromises in either genotype accuracy or complexity of permissible statistical methods. Here, we present a C/C++ library that dynamically compresses probabilistic genotype data as they are loaded into memory. This method uses a customization of the DEFLATE (gzip) algorithm, and maintains constant-time access to any SNP. Average compression ratios of more than 9-fold are observed in test data.
[ { "created": "Fri, 9 Aug 2013 15:13:28 GMT", "version": "v1" }, { "created": "Sun, 17 Nov 2013 21:27:44 GMT", "version": "v2" } ]
2013-11-19
[ [ "Palmer", "Cameron", "" ], [ "Pe'er", "Itsik", "" ] ]
Genome wide association studies directly assay 10^6 single nucleotide polymorphisms (SNPs) across a study cohort. Probabilistic estimation of additional sites by genotype imputation can increase this set of variants by 10- to 40-fold. Even with modest sample sizes (10^3-10^4), these resulting imputed datasets, containing 10^10-10^11 double-precision values, are incompatible with simultaneous lossless storage in RAM using standard methods. Existing solutions for this problem require compromises in either genotype accuracy or complexity of permissible statistical methods. Here, we present a C/C++ library that dynamically compresses probabilistic genotype data as they are loaded into memory. This method uses a customization of the DEFLATE (gzip) algorithm, and maintains constant-time access to any SNP. Average compression ratios of more than 9-fold are observed in test data.
1903.03964
J.K. Chen
Jiao-Kai Chen
Identical ideal individual hypothesis
7 pages. Part of the manuscript is rewritten and part is added. arXiv admin note: substantial text overlap with arXiv:1903.02633
null
null
null
q-bio.NC
http://creativecommons.org/licenses/by/4.0/
The identical ideal individual hypothesis is proposed. According to this hypothesis, the identical ideal individuals should be classified into two classes: the bosonic individuals and the fermionic individuals. The bosonic individuals can occupy the same behavior state while the fermionic individuals can not be in the same behavior state. We propose that human beings and many species of animals are fermionic, which can not occupy the same behavior state according to the Pauli exclusion principle. An unified theoretical explanation is given for the natures of two important and seemingly irrelated phenomena in psychology: the existence of the personal space and the behavior differentiation under high population density condition.
[ { "created": "Sun, 10 Mar 2019 10:06:53 GMT", "version": "v1" }, { "created": "Sun, 9 Jun 2019 12:30:38 GMT", "version": "v2" } ]
2019-06-12
[ [ "Chen", "Jiao-Kai", "" ] ]
The identical ideal individual hypothesis is proposed. According to this hypothesis, the identical ideal individuals should be classified into two classes: the bosonic individuals and the fermionic individuals. The bosonic individuals can occupy the same behavior state while the fermionic individuals can not be in the same behavior state. We propose that human beings and many species of animals are fermionic, which can not occupy the same behavior state according to the Pauli exclusion principle. An unified theoretical explanation is given for the natures of two important and seemingly irrelated phenomena in psychology: the existence of the personal space and the behavior differentiation under high population density condition.
1108.0289
Wojciech Waga
Stanislaw Cebrat, Dietrich Stauffer
Marry your Sister: Outbreeding Depression in Penna Ageing Model
7 pages, 7 figures
null
null
SMORF-02
q-bio.PE
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
If in the sexual Penna ageing model conditions are applied leading to complementary bit-strings, then marriages between brothers and sisters, or between close cousins, may lead to more offspring than for unrelated couples.
[ { "created": "Mon, 1 Aug 2011 11:50:48 GMT", "version": "v1" } ]
2011-08-02
[ [ "Cebrat", "Stanislaw", "" ], [ "Stauffer", "Dietrich", "" ] ]
If in the sexual Penna ageing model conditions are applied leading to complementary bit-strings, then marriages between brothers and sisters, or between close cousins, may lead to more offspring than for unrelated couples.
2207.11547
Song Li
Song Li, Song Ke, Chenxing Yang, Jun Chen, Yi Xiong, Lirong Zheng, Hao Liu, and Liang Hong
A Ligand-and-structure Dual-driven Deep Learning Method for the Discovery of Highly Potent GnRH1R Antagonist to treat Uterine Diseases
null
null
null
null
q-bio.BM cs.AI cs.LG
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
Gonadotrophin-releasing hormone receptor (GnRH1R) is a promising therapeutic target for the treatment of uterine diseases. To date, several GnRH1R antagonists are available in clinical investigation without satisfying multiple property constraints. To fill this gap, we aim to develop a deep learning-based framework to facilitate the effective and efficient discovery of a new orally active small-molecule drug targeting GnRH1R with desirable properties. In the present work, a ligand-and-structure combined model, namely LS-MolGen, was firstly proposed for molecular generation by fully utilizing the information on the known active compounds and the structure of the target protein, which was demonstrated by its superior performance than ligand- or structure-based methods separately. Then, a in silico screening including activity prediction, ADMET evaluation, molecular docking and FEP calculation was conducted, where ~30,000 generated novel molecules were narrowed down to 8 for experimental synthesis and validation. In vitro and in vivo experiments showed that three of them exhibited potent inhibition activities (compound 5 IC50 = 0.856 nM, compound 6 IC50 = 0.901 nM, compound 7 IC50 = 2.54 nM) against GnRH1R, and compound 5 performed well in fundamental PK properties, such as half-life, oral bioavailability, and PPB, etc. We believed that the proposed ligand-and-structure combined molecular generative model and the whole computer-aided workflow can potentially be extended to similar tasks for de novo drug design or lead optimization.
[ { "created": "Sat, 23 Jul 2022 16:04:54 GMT", "version": "v1" } ]
2022-07-26
[ [ "Li", "Song", "" ], [ "Ke", "Song", "" ], [ "Yang", "Chenxing", "" ], [ "Chen", "Jun", "" ], [ "Xiong", "Yi", "" ], [ "Zheng", "Lirong", "" ], [ "Liu", "Hao", "" ], [ "Hong", "Liang", "" ]...
Gonadotrophin-releasing hormone receptor (GnRH1R) is a promising therapeutic target for the treatment of uterine diseases. To date, several GnRH1R antagonists are available in clinical investigation without satisfying multiple property constraints. To fill this gap, we aim to develop a deep learning-based framework to facilitate the effective and efficient discovery of a new orally active small-molecule drug targeting GnRH1R with desirable properties. In the present work, a ligand-and-structure combined model, namely LS-MolGen, was firstly proposed for molecular generation by fully utilizing the information on the known active compounds and the structure of the target protein, which was demonstrated by its superior performance than ligand- or structure-based methods separately. Then, a in silico screening including activity prediction, ADMET evaluation, molecular docking and FEP calculation was conducted, where ~30,000 generated novel molecules were narrowed down to 8 for experimental synthesis and validation. In vitro and in vivo experiments showed that three of them exhibited potent inhibition activities (compound 5 IC50 = 0.856 nM, compound 6 IC50 = 0.901 nM, compound 7 IC50 = 2.54 nM) against GnRH1R, and compound 5 performed well in fundamental PK properties, such as half-life, oral bioavailability, and PPB, etc. We believed that the proposed ligand-and-structure combined molecular generative model and the whole computer-aided workflow can potentially be extended to similar tasks for de novo drug design or lead optimization.
1309.2817
Ulrich S. Schwarz
Ulrich S. Schwarz (Heidelberg University) and Samuel S. Safran (Weizmann Institute)
Physics of adherent cells
review, 60 pages, 25 figures
Reviews of Modern Physics 85: 1327-1381 (2013)
10.1103/RevModPhys.85.1327
null
q-bio.CB cond-mat.soft physics.bio-ph
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
One of the most unique physical features of cell adhesion to external surfaces is the active generation of mechanical force at the cell-material interface. This includes pulling forces generated by contractile polymer bundles and networks, and pushing forces generated by the polymerization of polymer networks. These forces are transmitted to the substrate mainly by focal adhesions, which are large, yet highly dynamic adhesion clusters. Tissue cells use these forces to sense the physical properties of their environment and to communicate with each other. The effect of forces is intricately linked to the material properties of cells and their physical environment. Here a review is given of recent progress in our understanding of the role of forces in cell adhesion from the viewpoint of theoretical soft matter physics and in close relation to the relevant experiments.
[ { "created": "Mon, 9 Sep 2013 16:19:12 GMT", "version": "v1" } ]
2013-09-12
[ [ "Schwarz", "Ulrich S.", "", "Heidelberg University" ], [ "Safran", "Samuel S.", "", "Weizmann Institute" ] ]
One of the most unique physical features of cell adhesion to external surfaces is the active generation of mechanical force at the cell-material interface. This includes pulling forces generated by contractile polymer bundles and networks, and pushing forces generated by the polymerization of polymer networks. These forces are transmitted to the substrate mainly by focal adhesions, which are large, yet highly dynamic adhesion clusters. Tissue cells use these forces to sense the physical properties of their environment and to communicate with each other. The effect of forces is intricately linked to the material properties of cells and their physical environment. Here a review is given of recent progress in our understanding of the role of forces in cell adhesion from the viewpoint of theoretical soft matter physics and in close relation to the relevant experiments.
0807.4729
Adrian Melott
Adrian L. Melott (University of Kansas)
Long-term cycles in the history of life: Periodic biodiversity in the Paleobiology Database
Published in PLoS ONE. 5 pages, 3 figures. Version with live links, discussion available at http://www.plosone.org/article/info:doi/10.1371/journal.pone.0004044#top
PLoS ONE 3(12): e4044. (2008)
10.1371/journal.pone.0004044
null
q-bio.PE astro-ph physics.bio-ph physics.data-an physics.geo-ph q-bio.QM stat.AP
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
Time series analysis of fossil biodiversity of marine invertebrates in the Paleobiology Database (PBDB) shows a significant periodicity at approximately 63 My, in agreement with previous analyses based on the Sepkoski database. I discuss how this result did not appear in a previous analysis of the PBDB. The existence of the 63 My periodicity, despite very different treatment of systematic error in both PBDB and Sepkoski databases strongly argues for consideration of its reality in the fossil record. Cross-spectral analysis of the two datasets finds that a 62 My periodicity coincides in phase by 1.6 My, equivalent to better than the errors in either measurement. Consequently, the two data sets not only contain the same strong periodicity, but its peaks and valleys closely correspond in time. Two other spectral peaks appear in the PBDB analysis, but appear to be artifacts associated with detrending and with the increased interval length. Sampling-standardization procedures implemented by the PBDB collaboration suggest that the signal is not an artifact of sampling bias. Further work should focus on finding the cause of the 62 My periodicity.
[ { "created": "Tue, 29 Jul 2008 20:01:51 GMT", "version": "v1" }, { "created": "Fri, 1 Aug 2008 14:23:30 GMT", "version": "v2" }, { "created": "Fri, 26 Sep 2008 19:56:34 GMT", "version": "v3" }, { "created": "Tue, 25 Nov 2008 13:36:31 GMT", "version": "v4" }, { "cr...
2016-09-08
[ [ "Melott", "Adrian L.", "", "University of Kansas" ] ]
Time series analysis of fossil biodiversity of marine invertebrates in the Paleobiology Database (PBDB) shows a significant periodicity at approximately 63 My, in agreement with previous analyses based on the Sepkoski database. I discuss how this result did not appear in a previous analysis of the PBDB. The existence of the 63 My periodicity, despite very different treatment of systematic error in both PBDB and Sepkoski databases strongly argues for consideration of its reality in the fossil record. Cross-spectral analysis of the two datasets finds that a 62 My periodicity coincides in phase by 1.6 My, equivalent to better than the errors in either measurement. Consequently, the two data sets not only contain the same strong periodicity, but its peaks and valleys closely correspond in time. Two other spectral peaks appear in the PBDB analysis, but appear to be artifacts associated with detrending and with the increased interval length. Sampling-standardization procedures implemented by the PBDB collaboration suggest that the signal is not an artifact of sampling bias. Further work should focus on finding the cause of the 62 My periodicity.
0907.4114
Ulrich S. Schwarz
Ilka B. Bischofs (1,2), Sebastian S. Schmidt (1,3) and Ulrich S. Schwarz (1,4) ((1) University of Heidelberg, Bioquant, (2) Lawrence Berkeley National Lab, (3) Helmholtz Center Berlin, (4) University of Karlsruhe, Theoretical Biophysics Group)
Effect of adhesion geometry and rigidity on cellular force distributions
4 pages, Revtex with 4 figures
Phys Rev Lett 103, 048101 (2009)
10.1103/PhysRevLett.103.048101
null
q-bio.CB cond-mat.soft
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
The behaviour and fate of tissue cells is controlled by the rigidity and geometry of their adhesive environment, possibly through forces localized to sites of adhesion. We introduce a mechanical model that predicts cellular force distributions for cells adhering to adhesive patterns with different geometries and rigidities. For continuous adhesion along a closed contour, forces are predicted to be localized to the corners. For discrete sites of adhesion, the model predicts the forces to be mainly determined by the lateral pull of the cell contour. With increasing distance between two neighboring sites of adhesion, the adhesion force increases because cell shape results in steeper pulling directions. Softer substrates result in smaller forces. Our predictions agree well with experimental force patterns measured on pillar assays.
[ { "created": "Thu, 23 Jul 2009 16:26:35 GMT", "version": "v1" } ]
2009-07-24
[ [ "Bischofs", "Ilka B.", "" ], [ "Schmidt", "Sebastian S.", "" ], [ "Schwarz", "Ulrich S.", "" ] ]
The behaviour and fate of tissue cells is controlled by the rigidity and geometry of their adhesive environment, possibly through forces localized to sites of adhesion. We introduce a mechanical model that predicts cellular force distributions for cells adhering to adhesive patterns with different geometries and rigidities. For continuous adhesion along a closed contour, forces are predicted to be localized to the corners. For discrete sites of adhesion, the model predicts the forces to be mainly determined by the lateral pull of the cell contour. With increasing distance between two neighboring sites of adhesion, the adhesion force increases because cell shape results in steeper pulling directions. Softer substrates result in smaller forces. Our predictions agree well with experimental force patterns measured on pillar assays.
0904.3308
Iaroslav Ispolatov
I. Ispolatov and Michael Doebeli
Speciation due to hybrid necrosis in plant-pathogen models
21 page, 3 figures
Evolution v. 63, December 2009, pp.: 3076-3084
10.1111/j.1558-5646.2009.00800.x
null
q-bio.PE q-bio.BM
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
We develop a model for speciation due to postzygotic incompatibility generated by autoimmune reactions. The model is based on predator-prey interactions between a host plants and their pathogens. Such interactions are often frequency-dependent, so that pathogen attack is focused on the most abundant plant phenotype, while rare plant types may escape pathogen attack. Thus, frequency dependence can generate disruptive selection, which can give rise to speciation if distant phenotypes become reproductively isolated. Based on recent experimental evidence from {\it Arabidopsis}, we assume that at the molecular level, incompatibility between strains is caused by epistatic interactions between two proteins in the plant immune system, the guard and the guardee. Within each plant strain, immune reactions occur when the guardee protein is modified by a pathogen effector, and the guard subsequently binds to the guardee, thus precipitating an immune response. However, when guard and guardee proteins come from phenotypically distant parents, a hybrid's immune system can be triggered by erroneous interactions between these proteins even in the absence of pathogen attack, leading to severe autoimmune reactions in hybrids. Our model shows how phenotypic variation generated by frequency-dependent host-pathogen interactions can lead to postzygotic incompatibility between extremal types, and hence to speciation.
[ { "created": "Tue, 21 Apr 2009 18:25:56 GMT", "version": "v1" } ]
2010-11-02
[ [ "Ispolatov", "I.", "" ], [ "Doebeli", "Michael", "" ] ]
We develop a model for speciation due to postzygotic incompatibility generated by autoimmune reactions. The model is based on predator-prey interactions between a host plants and their pathogens. Such interactions are often frequency-dependent, so that pathogen attack is focused on the most abundant plant phenotype, while rare plant types may escape pathogen attack. Thus, frequency dependence can generate disruptive selection, which can give rise to speciation if distant phenotypes become reproductively isolated. Based on recent experimental evidence from {\it Arabidopsis}, we assume that at the molecular level, incompatibility between strains is caused by epistatic interactions between two proteins in the plant immune system, the guard and the guardee. Within each plant strain, immune reactions occur when the guardee protein is modified by a pathogen effector, and the guard subsequently binds to the guardee, thus precipitating an immune response. However, when guard and guardee proteins come from phenotypically distant parents, a hybrid's immune system can be triggered by erroneous interactions between these proteins even in the absence of pathogen attack, leading to severe autoimmune reactions in hybrids. Our model shows how phenotypic variation generated by frequency-dependent host-pathogen interactions can lead to postzygotic incompatibility between extremal types, and hence to speciation.
2402.05815
Konstantin Kalitin
Konstantin Y. Kalitin, Alexander A. Spasov, Olga Y. Mukha
Effects of kappa-opioid agonist U-50488 and p38 MAPK inhibitor SB203580 on the spike activity of pyramidal neurons in the basolateral amygdala
null
Research Results in Pharmacology 10(1): 1-6 (2024)
10.18413/rrpharmacology.10.400
null
q-bio.NC
http://creativecommons.org/licenses/by/4.0/
Introduction: Kappa-opioid receptor (KOR) signaling in the basolateral amygdala (BLA) underlies KOR agonist-induced aversion. In this study, we aimed to understand the individual and combined effects of KOR agonist U-50488 and p38 MAPK inhibitor SB203580 on the spiking activity of pyramidal neurons in the BLA to shed light on the complex interplay between KORs, the p38 MAPK, and neuronal excitability. Materials and Methods: Electrophysiological experiments were performed using the patch-clamp technique in the whole-cell configuration. Rat brain slices containing the amygdala were prepared, and pyramidal neurons within the BLA were visually patched and recorded in the current clamp mode. The neurons were identified by their accommodation properties and neural activity signals were amplified and analyzed. Using local perfusion, we obtained three dose-response curves for: a) U-50488 (0.001-10 {\mu}M); b) U-50488 (0.001-10 {\mu}M) in the presence of SB203580 (1 {\mu}M); and c) U-50488 (0.01-10 {\mu}M) in the presence of SB203580 (5 {\mu}M). Results: After the application of U-50488, pyramidal neurons had a higher action potential firing rate in response to a current injection than control neurons (p<0.001). The dose-dependent curves we obtained indicate that the combination of U-50488 and SB203580 results in non-competitive antagonism. This conclusion is supported by the observed change in the curve`s slope with reduction in the maximum effect of U-50488. Thus, it can be assumed that the increase in spike activity of pyramidal neurons of the amygdala is mediated through the beta-arrestin pathway. When this pathway is blocked, the spike activity reverts to its baseline level. Conclusion: Our study found that the KOR agonist-induced spiking activity of the BLA pyramidal neurons is mediated by the beta-arrestin pathway and can be suppressed by the application of the p38 MAPK inhibitor SB203580.
[ { "created": "Thu, 8 Feb 2024 16:52:31 GMT", "version": "v1" }, { "created": "Sat, 17 Feb 2024 15:08:12 GMT", "version": "v2" } ]
2024-02-20
[ [ "Kalitin", "Konstantin Y.", "" ], [ "Spasov", "Alexander A.", "" ], [ "Mukha", "Olga Y.", "" ] ]
Introduction: Kappa-opioid receptor (KOR) signaling in the basolateral amygdala (BLA) underlies KOR agonist-induced aversion. In this study, we aimed to understand the individual and combined effects of KOR agonist U-50488 and p38 MAPK inhibitor SB203580 on the spiking activity of pyramidal neurons in the BLA to shed light on the complex interplay between KORs, the p38 MAPK, and neuronal excitability. Materials and Methods: Electrophysiological experiments were performed using the patch-clamp technique in the whole-cell configuration. Rat brain slices containing the amygdala were prepared, and pyramidal neurons within the BLA were visually patched and recorded in the current clamp mode. The neurons were identified by their accommodation properties and neural activity signals were amplified and analyzed. Using local perfusion, we obtained three dose-response curves for: a) U-50488 (0.001-10 {\mu}M); b) U-50488 (0.001-10 {\mu}M) in the presence of SB203580 (1 {\mu}M); and c) U-50488 (0.01-10 {\mu}M) in the presence of SB203580 (5 {\mu}M). Results: After the application of U-50488, pyramidal neurons had a higher action potential firing rate in response to a current injection than control neurons (p<0.001). The dose-dependent curves we obtained indicate that the combination of U-50488 and SB203580 results in non-competitive antagonism. This conclusion is supported by the observed change in the curve`s slope with reduction in the maximum effect of U-50488. Thus, it can be assumed that the increase in spike activity of pyramidal neurons of the amygdala is mediated through the beta-arrestin pathway. When this pathway is blocked, the spike activity reverts to its baseline level. Conclusion: Our study found that the KOR agonist-induced spiking activity of the BLA pyramidal neurons is mediated by the beta-arrestin pathway and can be suppressed by the application of the p38 MAPK inhibitor SB203580.
0705.1490
Emidio Capriotti
Emidio Capriotti, Piero Fariselli, Ivan Rossi and Rita Casadio
A three-state prediction of single point mutations on protein stability changes
Text: 9 pages, Figures: 9 pages, Tables: 1 page, Supplemetary Material: 1 page
null
null
null
q-bio.BM q-bio.QM
null
A basic question of protein structural studies is to which extent mutations affect the stability. This question may be addressed starting from sequence and/or from structure. In proteomics and genomics studies prediction of protein stability free energy change (DDG) upon single point mutation may also help the annotation process. The experimental SSG values are affected by uncertainty as measured by standard deviations. Most of the DDG values are nearly zero (about 32% of the DDG data set ranges from -0.5 to 0.5 Kcal/mol) and both the value and sign of DDG may be either positive or negative for the same mutation blurring the relationship among mutations and expected DDG value. In order to overcome this problem we describe a new predictor that discriminates between 3 mutation classes: destabilizing mutations (DDG<-0.5 Kcal/mol), stabilizing mutations (DDG>0.5 Kcal/mol) and neutral mutations (-0.5<=DDG<=0.5 Kcal/mol). In this paper a support vector machine starting from the protein sequence or structure discriminates between stabilizing, destabilizing and neutral mutations. We rank all the possible substitutions according to a three state classification system and show that the overall accuracy of our predictor is as high as 52% when performed starting from sequence information and 58% when the protein structure is available, with a mean value correlation coefficient of 0.30 and 0.39, respectively. These values are about 20 points per cent higher than those of a random predictor.
[ { "created": "Thu, 10 May 2007 14:37:34 GMT", "version": "v1" }, { "created": "Wed, 23 May 2007 08:49:48 GMT", "version": "v2" } ]
2007-06-13
[ [ "Capriotti", "Emidio", "" ], [ "Fariselli", "Piero", "" ], [ "Rossi", "Ivan", "" ], [ "Casadio", "Rita", "" ] ]
A basic question of protein structural studies is to which extent mutations affect the stability. This question may be addressed starting from sequence and/or from structure. In proteomics and genomics studies prediction of protein stability free energy change (DDG) upon single point mutation may also help the annotation process. The experimental SSG values are affected by uncertainty as measured by standard deviations. Most of the DDG values are nearly zero (about 32% of the DDG data set ranges from -0.5 to 0.5 Kcal/mol) and both the value and sign of DDG may be either positive or negative for the same mutation blurring the relationship among mutations and expected DDG value. In order to overcome this problem we describe a new predictor that discriminates between 3 mutation classes: destabilizing mutations (DDG<-0.5 Kcal/mol), stabilizing mutations (DDG>0.5 Kcal/mol) and neutral mutations (-0.5<=DDG<=0.5 Kcal/mol). In this paper a support vector machine starting from the protein sequence or structure discriminates between stabilizing, destabilizing and neutral mutations. We rank all the possible substitutions according to a three state classification system and show that the overall accuracy of our predictor is as high as 52% when performed starting from sequence information and 58% when the protein structure is available, with a mean value correlation coefficient of 0.30 and 0.39, respectively. These values are about 20 points per cent higher than those of a random predictor.
q-bio/0605047
Emmanuel Tannenbaum
Emmanuel Tannenbaum
When does division of labor lead to increased system output?
10 pages, submitted to the Journal of Theoretical Biology (figures are included with the journal version)
null
null
null
q-bio.CB q-bio.PE
null
This paper develops a set of simplified dynamical models with which to explore the conditions under which division of labor leads to optimized system output, as measured by the rate of production of a given product. We consider two models: In the first model, we consider the flow of some resource into a compartment, and the conversion of this resource into some product. In the second model, we consider the resource-limited growth of autoreplicating systems. In this case, we divide the replication and metabolic tasks among different agents. The general features that emerge from our models is that division of labor is favored when the resource to agent ratio is at intermediate values, and when the time cost associated with transporting intermediate products is small compared to characteristic process times. We discuss the results of this paper in the context of simulations with digital life. We also argue that division of labor in the context of our replication model suggests an evolutionary basis for the emergence of the stem-cell-based tissue architecture in complex organisms.
[ { "created": "Mon, 29 May 2006 22:49:31 GMT", "version": "v1" } ]
2007-05-23
[ [ "Tannenbaum", "Emmanuel", "" ] ]
This paper develops a set of simplified dynamical models with which to explore the conditions under which division of labor leads to optimized system output, as measured by the rate of production of a given product. We consider two models: In the first model, we consider the flow of some resource into a compartment, and the conversion of this resource into some product. In the second model, we consider the resource-limited growth of autoreplicating systems. In this case, we divide the replication and metabolic tasks among different agents. The general features that emerge from our models is that division of labor is favored when the resource to agent ratio is at intermediate values, and when the time cost associated with transporting intermediate products is small compared to characteristic process times. We discuss the results of this paper in the context of simulations with digital life. We also argue that division of labor in the context of our replication model suggests an evolutionary basis for the emergence of the stem-cell-based tissue architecture in complex organisms.
2102.03469
Anna Ritz
Heyuan Zeng, Jinbiao Zhang, Gabriel A. Preising, Tobias Rubel, Pramesh Singh, Anna Ritz
Graphery: Interactive Tutorials for Biological Network Algorithms
Added reference for pySnooper software
null
10.1093/nar/gkab420
null
q-bio.MN
http://creativecommons.org/licenses/by-nc-sa/4.0/
Networks provide a meaningful way to represent and analyze complex biological information, but the methodological details of network-based tools are often described for a technical audience. Graphery is a hands-on tutorial webserver designed to help biological researchers understand the fundamental concepts behind commonly-used graph algorithms. Each tutorial describes a graph concept along with executable Python code that visualizes the concept in a code view and a graph view. Graphery tutorials help researchers understand graph statistics (such as degree distribution and network modularity) and classic graph algorithms (such as shortest paths and random walks). Users navigate each tutorial using their choice of real-world biological networks, ranging in scale from molecular interaction graphs to ecological networks. Graphery also allows users to modify the code within each tutorial or write new programs, which all can be executed without requiring an account. Discipline-focused tutorials will be essential to help researchers interpret their biological data. Graphery accepts ideas for new tutorials and datasets that will be shaped by both computational and biological researchers, growing into a community-contributed learning platform. Availability: Graphery is available at https://graphery.reedcompbio.org/.
[ { "created": "Sat, 6 Feb 2021 01:27:17 GMT", "version": "v1" }, { "created": "Thu, 22 Apr 2021 23:47:54 GMT", "version": "v2" }, { "created": "Thu, 15 Feb 2024 21:14:51 GMT", "version": "v3" } ]
2024-02-19
[ [ "Zeng", "Heyuan", "" ], [ "Zhang", "Jinbiao", "" ], [ "Preising", "Gabriel A.", "" ], [ "Rubel", "Tobias", "" ], [ "Singh", "Pramesh", "" ], [ "Ritz", "Anna", "" ] ]
Networks provide a meaningful way to represent and analyze complex biological information, but the methodological details of network-based tools are often described for a technical audience. Graphery is a hands-on tutorial webserver designed to help biological researchers understand the fundamental concepts behind commonly-used graph algorithms. Each tutorial describes a graph concept along with executable Python code that visualizes the concept in a code view and a graph view. Graphery tutorials help researchers understand graph statistics (such as degree distribution and network modularity) and classic graph algorithms (such as shortest paths and random walks). Users navigate each tutorial using their choice of real-world biological networks, ranging in scale from molecular interaction graphs to ecological networks. Graphery also allows users to modify the code within each tutorial or write new programs, which all can be executed without requiring an account. Discipline-focused tutorials will be essential to help researchers interpret their biological data. Graphery accepts ideas for new tutorials and datasets that will be shaped by both computational and biological researchers, growing into a community-contributed learning platform. Availability: Graphery is available at https://graphery.reedcompbio.org/.
1503.02793
Nao Takashina
Nao Takashina and Marissa L. Baskett
Exploring the effect of the spatial scale of fishery management
21 pages, 5 figures
Journal of Theoretical Biology, 390:14-22, 2016
10.1016/j.jtbi.2015.11.005
null
q-bio.PE
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
For any spatially explicit management, determining the appropriate spatial scale of management decisions is critical to success at achieving a given management goal. Specifically, managers must decide how much to subdivide a given managed region: from implementing a uniform approach across the region to considering a unique approach in each of one hundred patches and everything in between. Spatially explicit approaches, such as the implementation of marine spatial planning and marine reserves, are increasingly used in fishery management. Using a spatially explicit bioeconomic model, we quantify how the management scale affects optimal fishery profit, biomass, fishery effort, and the fraction of habitat in marine reserves. We find that, if habitats are randomly distributed, the fishery profit increases almost linearly with the number of segments. However, if habitats are positively autocorrelated, then the fishery profit increases with diminishing returns. Therefore, the true optimum in management scale given cost to subdivision depends on the habitat distribution pattern.
[ { "created": "Tue, 10 Mar 2015 07:29:05 GMT", "version": "v1" }, { "created": "Sun, 6 Dec 2015 04:01:22 GMT", "version": "v2" } ]
2015-12-08
[ [ "Takashina", "Nao", "" ], [ "Baskett", "Marissa L.", "" ] ]
For any spatially explicit management, determining the appropriate spatial scale of management decisions is critical to success at achieving a given management goal. Specifically, managers must decide how much to subdivide a given managed region: from implementing a uniform approach across the region to considering a unique approach in each of one hundred patches and everything in between. Spatially explicit approaches, such as the implementation of marine spatial planning and marine reserves, are increasingly used in fishery management. Using a spatially explicit bioeconomic model, we quantify how the management scale affects optimal fishery profit, biomass, fishery effort, and the fraction of habitat in marine reserves. We find that, if habitats are randomly distributed, the fishery profit increases almost linearly with the number of segments. However, if habitats are positively autocorrelated, then the fishery profit increases with diminishing returns. Therefore, the true optimum in management scale given cost to subdivision depends on the habitat distribution pattern.
2211.03978
Don Krieger
Don Krieger, Paul Shepard, David O. Okonkwo
Robust Functional Magnetoencephalographic Brain Measures with 1.0 Millimeter Spatial Separation
14 pages, 4 figures
null
null
null
q-bio.NC
http://creativecommons.org/licenses/by-nc-nd/4.0/
Neuroelectric currents were extracted from free-running magnetoencephalographic (MEG) rest and task recordings from 617 normative subjects (ages: 18-87). State-dependent neuroelectric differential activation (DA) with spatial resolution comparable to that of local field potentials was detected in the majority of this cohort. Rest-high (rest greater than task) or task-high DA was found in the majority of individual subjects in more than 13,000 1 mm^3 voxels per subject. On average, 6% of the DA voxels bordered a second voxel whose DA was opposite, i.e., one was rest-high and the other was task-high. 516 subjects showed more than 100 such opposite voxel pairs 1 mm apart; 226 subjects showed more than 1000. The number of bordering voxel pairs with the same DA was consistently higher for almost all subjects and averaged 20%, ruling out the possibility that opposite bordering voxels occur simply by chance. For 65 brain regions, more than 10% of the cohort showed significantly more same than opposite pairs. These findings taken together support the conclusion that neuroelectric DA is consistently distinguishable at single 1 mm^3 brain voxels with 1-mm spatial separation. When restricted to voxels with near-zero rest or task counts, significantly more rest-high than task-high voxels were found in 35 regions for at least 10 percent of the subjects. This inequality was not found when all DA-voxels were included. This supports the conclusion that the DA found in many rest-high voxels with near-zero task counts is due in part to task-dependent inhibition.
[ { "created": "Tue, 8 Nov 2022 03:16:07 GMT", "version": "v1" }, { "created": "Wed, 16 Nov 2022 17:41:28 GMT", "version": "v2" }, { "created": "Sun, 18 Dec 2022 18:11:29 GMT", "version": "v3" }, { "created": "Sat, 31 Dec 2022 13:55:46 GMT", "version": "v4" } ]
2023-01-03
[ [ "Krieger", "Don", "" ], [ "Shepard", "Paul", "" ], [ "Okonkwo", "David O.", "" ] ]
Neuroelectric currents were extracted from free-running magnetoencephalographic (MEG) rest and task recordings from 617 normative subjects (ages: 18-87). State-dependent neuroelectric differential activation (DA) with spatial resolution comparable to that of local field potentials was detected in the majority of this cohort. Rest-high (rest greater than task) or task-high DA was found in the majority of individual subjects in more than 13,000 1 mm^3 voxels per subject. On average, 6% of the DA voxels bordered a second voxel whose DA was opposite, i.e., one was rest-high and the other was task-high. 516 subjects showed more than 100 such opposite voxel pairs 1 mm apart; 226 subjects showed more than 1000. The number of bordering voxel pairs with the same DA was consistently higher for almost all subjects and averaged 20%, ruling out the possibility that opposite bordering voxels occur simply by chance. For 65 brain regions, more than 10% of the cohort showed significantly more same than opposite pairs. These findings taken together support the conclusion that neuroelectric DA is consistently distinguishable at single 1 mm^3 brain voxels with 1-mm spatial separation. When restricted to voxels with near-zero rest or task counts, significantly more rest-high than task-high voxels were found in 35 regions for at least 10 percent of the subjects. This inequality was not found when all DA-voxels were included. This supports the conclusion that the DA found in many rest-high voxels with near-zero task counts is due in part to task-dependent inhibition.
1801.03011
Matteo Manica
Matteo Manica, Roland Mathis, Mar\'ia Rodr\'iguez Mart\'inez
INtERAcT: Interaction Network Inference from Vector Representations of Words
null
Nature Machine Intelligence (2019)
10.1038/s42256-019-0036-1
null
q-bio.MN
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
In recent years, the number of biomedical publications has steadfastly grown, resulting in a rich source of untapped new knowledge. Most biomedical facts are however not readily available, but buried in the form of unstructured text, and hence their exploitation requires the time-consuming manual curation of published articles. Here we present INtERAcT, a novel approach to extract protein-protein interactions from a corpus of biomedical articles related to a broad range of scientific domains in a completely unsupervised way. INtERAcT exploits vector representation of words, computed on a corpus of domain specific knowledge, and implements a new metric that estimates an interaction score between two molecules in the space where the corresponding words are embedded. We demonstrate the power of INtERAcT by reconstructing the molecular pathways associated to 10 different cancer types using a corpus of disease-specific articles for each cancer type. We evaluate INtERAcT using STRING database as a benchmark, and show that our metric outperforms currently adopted approaches for similarity computation at the task of identifying known molecular interactions in all studied cancer types. Furthermore, our approach does not require text annotation, manual curation or the definition of semantic rules based on expert knowledge, and hence it can be easily and efficiently applied to different scientific domains. Our findings suggest that INtERAcT may increase our capability to summarize the understanding of a specific disease using the published literature in an automated and completely unsupervised fashion.
[ { "created": "Tue, 9 Jan 2018 15:43:37 GMT", "version": "v1" }, { "created": "Mon, 12 Mar 2018 13:31:51 GMT", "version": "v2" }, { "created": "Mon, 16 Apr 2018 09:55:21 GMT", "version": "v3" } ]
2019-11-07
[ [ "Manica", "Matteo", "" ], [ "Mathis", "Roland", "" ], [ "Martínez", "María Rodríguez", "" ] ]
In recent years, the number of biomedical publications has steadfastly grown, resulting in a rich source of untapped new knowledge. Most biomedical facts are however not readily available, but buried in the form of unstructured text, and hence their exploitation requires the time-consuming manual curation of published articles. Here we present INtERAcT, a novel approach to extract protein-protein interactions from a corpus of biomedical articles related to a broad range of scientific domains in a completely unsupervised way. INtERAcT exploits vector representation of words, computed on a corpus of domain specific knowledge, and implements a new metric that estimates an interaction score between two molecules in the space where the corresponding words are embedded. We demonstrate the power of INtERAcT by reconstructing the molecular pathways associated to 10 different cancer types using a corpus of disease-specific articles for each cancer type. We evaluate INtERAcT using STRING database as a benchmark, and show that our metric outperforms currently adopted approaches for similarity computation at the task of identifying known molecular interactions in all studied cancer types. Furthermore, our approach does not require text annotation, manual curation or the definition of semantic rules based on expert knowledge, and hence it can be easily and efficiently applied to different scientific domains. Our findings suggest that INtERAcT may increase our capability to summarize the understanding of a specific disease using the published literature in an automated and completely unsupervised fashion.
1901.07454
Alexander Peyser
Nora Abi Akar, Ben Cumming, Vasileios Karakasis, Anne K\"usters, Wouter Klijn, Alexander Peyser, Stuart Yates
Arbor -- a morphologically-detailed neural network simulation library for contemporary high-performance computing architectures
PDP 2019 27th Euromicro International Conference on Parallel, Distributed and Network-based Processing
2019 27th Euromicro International Conference on Parallel, Distributed and Network-Based Processing (PDP), Pavia, Italy, 2019, pp. 274-282
10.1109/EMPDP.2019.8671560
null
q-bio.NC
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
We introduce Arbor, a performance portable library for simulation of large networks of multi-compartment neurons on HPC systems. Arbor is open source software, developed under the auspices of the HBP. The performance portability is by virtue of back-end specific optimizations for x86 multicore, Intel KNL, and NVIDIA GPUs. When coupled with low memory overheads, these optimizations make Arbor an order of magnitude faster than the most widely-used comparable simulation software. The single-node performance can be scaled out to run very large models at extreme scale with efficient weak scaling. HPC, GPU, neuroscience, neuron, software
[ { "created": "Thu, 17 Jan 2019 07:44:39 GMT", "version": "v1" } ]
2019-04-12
[ [ "Akar", "Nora Abi", "" ], [ "Cumming", "Ben", "" ], [ "Karakasis", "Vasileios", "" ], [ "Küsters", "Anne", "" ], [ "Klijn", "Wouter", "" ], [ "Peyser", "Alexander", "" ], [ "Yates", "Stuart", "" ] ]
We introduce Arbor, a performance portable library for simulation of large networks of multi-compartment neurons on HPC systems. Arbor is open source software, developed under the auspices of the HBP. The performance portability is by virtue of back-end specific optimizations for x86 multicore, Intel KNL, and NVIDIA GPUs. When coupled with low memory overheads, these optimizations make Arbor an order of magnitude faster than the most widely-used comparable simulation software. The single-node performance can be scaled out to run very large models at extreme scale with efficient weak scaling. HPC, GPU, neuroscience, neuron, software
2301.11262
Madhur Mangalam
Aaron D. Likens, Madhur Mangalam, Aaron Y. Wong, Anaelle C. Charles, Caitlin Mills
Better than DFA? A Bayesian Method for Estimating the Hurst Exponent in Behavioral Sciences
50 pages, 14 figures, 6 tables
null
null
null
q-bio.QM
http://creativecommons.org/licenses/by-nc-nd/4.0/
Detrended Fluctuation Analysis (DFA) is the most popular fractal analytical technique used to evaluate the strength of long-range correlations in empirical time series in terms of the Hurst exponent, $H$. Specifically, DFA quantifies the linear regression slope in log-log coordinates representing the relationship between the time series' variability and the number of timescales over which this variability is computed. We compared the performance of two methods of fractal analysis -- the current gold standard, DFA, and a Bayesian method that is not currently well-known in behavioral sciences: the Hurst-Kolmogorov (HK) method -- in estimating the Hurst exponent of synthetic and empirical time series. Simulations demonstrate that the HK method consistently outperforms DFA in three important ways. The HK method: (i) accurately assesses long-range correlations when the measurement time series is short, (ii) shows minimal dispersion about the central tendency, and (iii) yields a point estimate that does not depend on the length of the measurement time series or its underlying Hurst exponent. Comparing the two methods using empirical time series from multiple settings further supports these findings. We conclude that applying DFA to synthetic time series and empirical time series during brief trials is unreliable and encourage the systematic application of the HK method to assess the Hurst exponent of empirical time series in behavioral sciences.
[ { "created": "Thu, 26 Jan 2023 18:00:44 GMT", "version": "v1" } ]
2023-01-27
[ [ "Likens", "Aaron D.", "" ], [ "Mangalam", "Madhur", "" ], [ "Wong", "Aaron Y.", "" ], [ "Charles", "Anaelle C.", "" ], [ "Mills", "Caitlin", "" ] ]
Detrended Fluctuation Analysis (DFA) is the most popular fractal analytical technique used to evaluate the strength of long-range correlations in empirical time series in terms of the Hurst exponent, $H$. Specifically, DFA quantifies the linear regression slope in log-log coordinates representing the relationship between the time series' variability and the number of timescales over which this variability is computed. We compared the performance of two methods of fractal analysis -- the current gold standard, DFA, and a Bayesian method that is not currently well-known in behavioral sciences: the Hurst-Kolmogorov (HK) method -- in estimating the Hurst exponent of synthetic and empirical time series. Simulations demonstrate that the HK method consistently outperforms DFA in three important ways. The HK method: (i) accurately assesses long-range correlations when the measurement time series is short, (ii) shows minimal dispersion about the central tendency, and (iii) yields a point estimate that does not depend on the length of the measurement time series or its underlying Hurst exponent. Comparing the two methods using empirical time series from multiple settings further supports these findings. We conclude that applying DFA to synthetic time series and empirical time series during brief trials is unreliable and encourage the systematic application of the HK method to assess the Hurst exponent of empirical time series in behavioral sciences.
1906.10184
Karl Friston
Karl Friston
A free energy principle for a particular physics
null
null
null
null
q-bio.NC
http://creativecommons.org/licenses/by/4.0/
This monograph attempts a theory of every 'thing' that can be distinguished from other things in a statistical sense. The ensuing statistical independencies, mediated by Markov blankets, speak to a recursive composition of ensembles (of things) at increasingly higher spatiotemporal scales. This decomposition provides a description of small things; e.g., quantum mechanics - via the Schrodinger equation, ensembles of small things - via statistical mechanics and related fluctuation theorems, through to big things - via classical mechanics. These descriptions are complemented with a Bayesian mechanics for autonomous or active things. Although this work provides a formulation of every thing, its main contribution is to examine the implications of Markov blankets for self-organisation to nonequilibrium steady-state. In brief, we recover an information geometry and accompanying free energy principle that allows one to interpret the internal states of something as representing or making inferences about its external states. The ensuing Bayesian mechanics is compatible with quantum, statistical and classical mechanics and may offer a formal description of lifelike particles.
[ { "created": "Mon, 24 Jun 2019 19:18:37 GMT", "version": "v1" } ]
2019-06-26
[ [ "Friston", "Karl", "" ] ]
This monograph attempts a theory of every 'thing' that can be distinguished from other things in a statistical sense. The ensuing statistical independencies, mediated by Markov blankets, speak to a recursive composition of ensembles (of things) at increasingly higher spatiotemporal scales. This decomposition provides a description of small things; e.g., quantum mechanics - via the Schrodinger equation, ensembles of small things - via statistical mechanics and related fluctuation theorems, through to big things - via classical mechanics. These descriptions are complemented with a Bayesian mechanics for autonomous or active things. Although this work provides a formulation of every thing, its main contribution is to examine the implications of Markov blankets for self-organisation to nonequilibrium steady-state. In brief, we recover an information geometry and accompanying free energy principle that allows one to interpret the internal states of something as representing or making inferences about its external states. The ensuing Bayesian mechanics is compatible with quantum, statistical and classical mechanics and may offer a formal description of lifelike particles.
2305.14360
Alberto Lovison Dr.
Franco Cardin, Alberto Lovison, Amos Maritan and Aram Megighian
Brain memory working. Optimal control behavior for improved Hopfield-like models
8 pages, 3 figure
null
null
null
q-bio.NC
http://creativecommons.org/licenses/by/4.0/
Several authors have recently highlighted the need for a new dynamical paradigm in the modelling of brain working and evolution. In particular, the models should include the possibility of non constant and non symmetric synaptic weights $T_{ij}$ in the neuron-neuron interaction matrix, radically overcoming the classical Hopfield setting. Krotov and Hopfield have proposed a non constant, still symmetric model, leading to a vector field describing a gradient type dynamics then including a Lyapunov-like energy function. In this note, we first will detail the general condition to produce a Hopfield like vector field of gradient type obtaining, as a particular case, the Krotov-Hopfield condition. Secondly, we abandon the symmetry because of two relevant physiological facts: (1) the actual neural connections have a marked directional character and (2) the gradient structure deriving from the symmetry forces the dynamics always towards stationary points, prescribing every pattern to be recognized. We propose a novel model including a set of limited but varying controls $|\xi_{ij}|\leq K$ used for correcting a starting constant interaction matrix, $T_{ij}=A_{ij}+\xi_{ij}$. Besides, we introduce a reasonable controlled variational functional to be optimized. This allows us to reproduce the following three possible outcomes when submitting a pattern to the learning system. If (1) the dynamics leads to an already existing stationary point without activating the controls, the system has \emph{recognized} an existing pattern. If (2) a new stationary point is reached by the activation of controls, then the system has \emph{learned} a new pattern. If (3) the dynamics is \emph{wandering} without reaching neither existing or new stationary points, then the system is unable to recognize or learn the pattern submitted. A further feature (4), appears to model \emph{forgetting and restoring} memory.
[ { "created": "Thu, 11 May 2023 09:59:12 GMT", "version": "v1" }, { "created": "Sat, 13 Jan 2024 14:11:54 GMT", "version": "v2" }, { "created": "Sun, 28 Apr 2024 12:59:59 GMT", "version": "v3" } ]
2024-04-30
[ [ "Cardin", "Franco", "" ], [ "Lovison", "Alberto", "" ], [ "Maritan", "Amos", "" ], [ "Megighian", "Aram", "" ] ]
Several authors have recently highlighted the need for a new dynamical paradigm in the modelling of brain working and evolution. In particular, the models should include the possibility of non constant and non symmetric synaptic weights $T_{ij}$ in the neuron-neuron interaction matrix, radically overcoming the classical Hopfield setting. Krotov and Hopfield have proposed a non constant, still symmetric model, leading to a vector field describing a gradient type dynamics then including a Lyapunov-like energy function. In this note, we first will detail the general condition to produce a Hopfield like vector field of gradient type obtaining, as a particular case, the Krotov-Hopfield condition. Secondly, we abandon the symmetry because of two relevant physiological facts: (1) the actual neural connections have a marked directional character and (2) the gradient structure deriving from the symmetry forces the dynamics always towards stationary points, prescribing every pattern to be recognized. We propose a novel model including a set of limited but varying controls $|\xi_{ij}|\leq K$ used for correcting a starting constant interaction matrix, $T_{ij}=A_{ij}+\xi_{ij}$. Besides, we introduce a reasonable controlled variational functional to be optimized. This allows us to reproduce the following three possible outcomes when submitting a pattern to the learning system. If (1) the dynamics leads to an already existing stationary point without activating the controls, the system has \emph{recognized} an existing pattern. If (2) a new stationary point is reached by the activation of controls, then the system has \emph{learned} a new pattern. If (3) the dynamics is \emph{wandering} without reaching neither existing or new stationary points, then the system is unable to recognize or learn the pattern submitted. A further feature (4), appears to model \emph{forgetting and restoring} memory.
1512.08970
Valmir Barbosa
Valmir C. Barbosa, Raul Donangelo, Sergio R. Souza
Quasispecies dynamics on a network of interacting genotypes and idiotypes: Applications to autoimmunity and immunodeficiency
null
Journal of Statistical Mechanics (2016), 063501
10.1088/1742-5468/2016/06/063501
null
q-bio.PE cond-mat.stat-mech
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
In spite of their many facets, the phenomena of autoimmunity and immunodeficiency seem to be related to each other through the subtle links connecting retroviral mutation and action to immune response and adaptation. In a previous work, we introduced a network model of how a set of interrelated genotypes (called a quasispecies, in the stationary state) and a set of interrelated idiotypes (an idiotypic network) interact. That model, which does not cover the case of a retroviral quasispecies, was instrumental for the study of quasispecies survival when confronting the immune system and led to the conclusion that, unlike what happens when a quasispecies is left to evolve by itself, letting genotypes mutate too infrequently leads to the destruction of the quasispecies. Here we extend that genotype-idiotype interaction model by the addition of a further parameter ($\nu$) to account for the action of retroviruses (i.e., the destruction of idiotypes by genotypes). We give simulation results within a suitable parameter niche, highlighting the issues of quasispecies survival and of the onset of autoimmunity through the appearance of the so-called pathogenic idiotypes. Our main findings refer to how $\nu$ and $\lambda$, a parameter describing the rate at which idiotypes get stimulated, relate to each other. While for $\nu>\lambda$ the quasispecies survives at the expense of weakening the immune system significantly or even destroying it, for $\nu<\lambda$ the fittest genotypes of the quasispecies become mimicked inside the immune system as pathogenic idiotypes. The latter is in agreement with the current understanding of the HIV quasispecies.
[ { "created": "Wed, 30 Dec 2015 15:12:17 GMT", "version": "v1" } ]
2016-07-01
[ [ "Barbosa", "Valmir C.", "" ], [ "Donangelo", "Raul", "" ], [ "Souza", "Sergio R.", "" ] ]
In spite of their many facets, the phenomena of autoimmunity and immunodeficiency seem to be related to each other through the subtle links connecting retroviral mutation and action to immune response and adaptation. In a previous work, we introduced a network model of how a set of interrelated genotypes (called a quasispecies, in the stationary state) and a set of interrelated idiotypes (an idiotypic network) interact. That model, which does not cover the case of a retroviral quasispecies, was instrumental for the study of quasispecies survival when confronting the immune system and led to the conclusion that, unlike what happens when a quasispecies is left to evolve by itself, letting genotypes mutate too infrequently leads to the destruction of the quasispecies. Here we extend that genotype-idiotype interaction model by the addition of a further parameter ($\nu$) to account for the action of retroviruses (i.e., the destruction of idiotypes by genotypes). We give simulation results within a suitable parameter niche, highlighting the issues of quasispecies survival and of the onset of autoimmunity through the appearance of the so-called pathogenic idiotypes. Our main findings refer to how $\nu$ and $\lambda$, a parameter describing the rate at which idiotypes get stimulated, relate to each other. While for $\nu>\lambda$ the quasispecies survives at the expense of weakening the immune system significantly or even destroying it, for $\nu<\lambda$ the fittest genotypes of the quasispecies become mimicked inside the immune system as pathogenic idiotypes. The latter is in agreement with the current understanding of the HIV quasispecies.
0709.3049
David A. Kessler
David A. Kessler
Epidemic Size in the Sis Model of Endemic Infec- Tions
null
null
null
null
q-bio.PE
null
We study the Susceptible-Infected-Susceptible model of the spread of an endemic infection. We calculate an exact expression for the mean number of transmissions for all values of the population and the infectivity. We derive the large-N asymptotic behavior for the infectivitiy below, above, and in the critical region. We obtain an analytical expression for the probability distribution of the number of transmissions, n, in the critical region. We show that this distribution has a $n^3/2$ singularity for small n and decays exponentially for large n. The exponent decreases with the distance from threshold, diverging to infinity far below and approaching zero far above.
[ { "created": "Wed, 19 Sep 2007 15:45:01 GMT", "version": "v1" } ]
2007-09-20
[ [ "Kessler", "David A.", "" ] ]
We study the Susceptible-Infected-Susceptible model of the spread of an endemic infection. We calculate an exact expression for the mean number of transmissions for all values of the population and the infectivity. We derive the large-N asymptotic behavior for the infectivitiy below, above, and in the critical region. We obtain an analytical expression for the probability distribution of the number of transmissions, n, in the critical region. We show that this distribution has a $n^3/2$ singularity for small n and decays exponentially for large n. The exponent decreases with the distance from threshold, diverging to infinity far below and approaching zero far above.
1410.5362
Saptarshi Das
Wasifa Jamal, Saptarshi Das, Ioana-Anastasia Oprescu, Koushik Maharatna
Prediction of Synchrostate Transitions in EEG Signals Using Markov Chain Models
5 pages, 5 figures
Signal Processing Letters, IEEE, Volume 22, Issue 2, Pages 149 - 152, Feb. 2015
10.1109/LSP.2014.2352251
null
q-bio.NC physics.med-ph stat.AP stat.ML
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
This paper proposes a stochastic model using the concept of Markov chains for the inter-state transitions of the millisecond order quasi-stable phase synchronized patterns or synchrostates, found in multi-channel Electroencephalogram (EEG) signals. First and second order transition probability matrices are estimated for Markov chain modelling from 100 trials of 128-channel EEG signals during two different face perception tasks. Prediction accuracies with such finite Markov chain models for synchrostate transition are also compared, under a data-partitioning based cross-validation scheme.
[ { "created": "Mon, 20 Oct 2014 17:28:13 GMT", "version": "v1" } ]
2014-10-21
[ [ "Jamal", "Wasifa", "" ], [ "Das", "Saptarshi", "" ], [ "Oprescu", "Ioana-Anastasia", "" ], [ "Maharatna", "Koushik", "" ] ]
This paper proposes a stochastic model using the concept of Markov chains for the inter-state transitions of the millisecond order quasi-stable phase synchronized patterns or synchrostates, found in multi-channel Electroencephalogram (EEG) signals. First and second order transition probability matrices are estimated for Markov chain modelling from 100 trials of 128-channel EEG signals during two different face perception tasks. Prediction accuracies with such finite Markov chain models for synchrostate transition are also compared, under a data-partitioning based cross-validation scheme.
1807.05684
Ehtibar Dzhafarov
Irina Basieva, V\'ictor H. Cervantes, Ehtibar N. Dzhafarov, Andrei Khrennikov
True Contextuality Beats Direct Influences in Human Decision Making
Journal of Experimental Psychology: General 148, 1925-1937
Journal of Experimental Psychology: General 148, 1925-1937
10.1037/xge0000585
null
q-bio.NC quant-ph
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
In quantum physics there are well-known situations when measurements of the same property in different contexts (under different conditions) have the same probability distribution, but cannot be represented by one and the same random variable. Such systems of random variables are called contextual. More generally, true contextuality is observed when different contexts force measurements of the same property (in psychology, responses to the same question) to be more dissimilar random variables than warranted by the difference of their distributions. The difference in distributions is itself a form of context-dependence, but of another nature: it is attributable to direct causal influences exerted by contexts upon the random variables. The Contextuality-by-Default (CbD) theory allows one to separate true contextuality from direct influences in the overall context-dependence. The CbD analysis of numerous previous attempts to demonstrate contextuality in human judgments shows that all context-dependence in them can be accounted for by direct influences, with no true contextuality present. However, contextual systems in human behavior can be found. In this paper we present a series of crowdsourcing experiments that exhibit true contextuality in simple decision making.}{The design of these experiments is an elaboration of one introduced in the "Snow Queen" experiment (Decision 5, 193-204, 2018), where contextuality was for the first time demonstrated unequivocally.
[ { "created": "Mon, 16 Jul 2018 05:31:04 GMT", "version": "v1" }, { "created": "Fri, 30 Nov 2018 23:05:06 GMT", "version": "v2" }, { "created": "Wed, 23 Jan 2019 14:50:14 GMT", "version": "v3" }, { "created": "Sat, 30 May 2020 16:47:08 GMT", "version": "v4" } ]
2020-06-02
[ [ "Basieva", "Irina", "" ], [ "Cervantes", "Víctor H.", "" ], [ "Dzhafarov", "Ehtibar N.", "" ], [ "Khrennikov", "Andrei", "" ] ]
In quantum physics there are well-known situations when measurements of the same property in different contexts (under different conditions) have the same probability distribution, but cannot be represented by one and the same random variable. Such systems of random variables are called contextual. More generally, true contextuality is observed when different contexts force measurements of the same property (in psychology, responses to the same question) to be more dissimilar random variables than warranted by the difference of their distributions. The difference in distributions is itself a form of context-dependence, but of another nature: it is attributable to direct causal influences exerted by contexts upon the random variables. The Contextuality-by-Default (CbD) theory allows one to separate true contextuality from direct influences in the overall context-dependence. The CbD analysis of numerous previous attempts to demonstrate contextuality in human judgments shows that all context-dependence in them can be accounted for by direct influences, with no true contextuality present. However, contextual systems in human behavior can be found. In this paper we present a series of crowdsourcing experiments that exhibit true contextuality in simple decision making.}{The design of these experiments is an elaboration of one introduced in the "Snow Queen" experiment (Decision 5, 193-204, 2018), where contextuality was for the first time demonstrated unequivocally.
q-bio/0703054
Concetta Miccio
C. Destri, C. Miccio
A simple stochastic model for the evolution of protein lengths
12 pages, 4 figures
null
10.1103/PhysRevE.76.011924
null
q-bio.PE q-bio.QM
null
We analyse a simple discrete-time stochastic process for the theoretical modeling of the evolution of protein lengths. At every step of the process a new protein is produced as a modification of one of the proteins already existing and its length is assumed to be random variable which depends only on the length of the originating protein. Thus a Random Recursive Trees (RRT) is produced over the natural integers. If (quasi) scale invariance is assumed, the length distribution in a single history tends to a lognormal form with a specific signature of the deviations from exact gaussianity. Comparison with the very large SIMAP protein database shows good agreement.
[ { "created": "Mon, 26 Mar 2007 14:20:02 GMT", "version": "v1" }, { "created": "Mon, 26 Mar 2007 22:08:31 GMT", "version": "v2" } ]
2009-11-13
[ [ "Destri", "C.", "" ], [ "Miccio", "C.", "" ] ]
We analyse a simple discrete-time stochastic process for the theoretical modeling of the evolution of protein lengths. At every step of the process a new protein is produced as a modification of one of the proteins already existing and its length is assumed to be random variable which depends only on the length of the originating protein. Thus a Random Recursive Trees (RRT) is produced over the natural integers. If (quasi) scale invariance is assumed, the length distribution in a single history tends to a lognormal form with a specific signature of the deviations from exact gaussianity. Comparison with the very large SIMAP protein database shows good agreement.
1103.2834
Swagatam Mukhopadhyay
Swagatam Mukhopadhyay, Paul D. Schedl, Vasily M. Studitsky and Anirvan M. Sengupta
Theoretical analysis of the role of chromatin interactions in long-range action of enhancers and insulators
10 pages, originally submitted to an (undisclosed) journal in May 2010
null
10.1073/pnas.1103845108
null
q-bio.SC
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
Long-distance regulatory interactions between enhancers and their target genes are commonplace in higher eukaryotes. Interposed boundaries or insulators are able to block these long distance regulatory interactions. The mechanistic basis for insulator activity and how it relates to enhancer action-at-a-distance remains unclear. Here we explore the idea that topological loops could simultaneously account for regulatory interactions of distal enhancers and the insulating activity of boundary elements. We show that while loop formation is not in itself sufficient to explain action at a distance, incorporating transient non-specific and moderate attractive interactions between the chromatin fibers strongly enhances long-distance regulatory interactions and is sufficient to generate a euchromatin-like state. Under these same conditions, the subdivision of the loop into two topologically independent loops by insulators inhibits inter-domain interactions. The underlying cause of this effect is a suppression of crossings in the contact map at intermediate distances. Thus our model simultaneously accounts for regulatory interactions at a distance and the insulator activity of boundary elements. This unified model of the regulatory roles of chromatin loops makes several testable predictions that could be confronted with \emph{in vitro} experiments, as well as genomic chromatin conformation capture and fluorescent microscopic approaches.
[ { "created": "Tue, 15 Mar 2011 03:09:12 GMT", "version": "v1" } ]
2015-05-27
[ [ "Mukhopadhyay", "Swagatam", "" ], [ "Schedl", "Paul D.", "" ], [ "Studitsky", "Vasily M.", "" ], [ "Sengupta", "Anirvan M.", "" ] ]
Long-distance regulatory interactions between enhancers and their target genes are commonplace in higher eukaryotes. Interposed boundaries or insulators are able to block these long distance regulatory interactions. The mechanistic basis for insulator activity and how it relates to enhancer action-at-a-distance remains unclear. Here we explore the idea that topological loops could simultaneously account for regulatory interactions of distal enhancers and the insulating activity of boundary elements. We show that while loop formation is not in itself sufficient to explain action at a distance, incorporating transient non-specific and moderate attractive interactions between the chromatin fibers strongly enhances long-distance regulatory interactions and is sufficient to generate a euchromatin-like state. Under these same conditions, the subdivision of the loop into two topologically independent loops by insulators inhibits inter-domain interactions. The underlying cause of this effect is a suppression of crossings in the contact map at intermediate distances. Thus our model simultaneously accounts for regulatory interactions at a distance and the insulator activity of boundary elements. This unified model of the regulatory roles of chromatin loops makes several testable predictions that could be confronted with \emph{in vitro} experiments, as well as genomic chromatin conformation capture and fluorescent microscopic approaches.
1709.07211
Mahmoud Hassan
Ahmad Mheich (LTSI), Mahmoud Hassan (LTSI), Mohamad Khalil, Vincent Gripon (ELEC), Olivier Dufor, Fabrice Wendling (LTSI)
SimiNet: a Novel Method for Quantifying Brain Network Similarity
null
IEEE Transactions on Pattern Analysis and Machine Intelligence, Institute of Electrical and Electronics Engineers, 2017, pp.1 - 1
10.1109/TPAMI.2017.2750160
null
q-bio.NC
http://arxiv.org/licenses/nonexclusive-distrib/1.0/
Quantifying the similarity between two networks is critical in many applications. A number of algorithms have been proposed to compute graph similarity, mainly based on the properties of nodes and edges. Interestingly, most of these algorithms ignore the physical location of the nodes, which is a key factor in the context of brain networks involving spatially defined functional areas. In this paper, we present a novel algorithm called "SimiNet" for measuring similarity between two graphs whose nodes are defined a priori within a 3D coordinate system. SimiNet provides a quantified index (ranging from 0 to 1) that accounts for node, edge and spatiality features. Complex graphs were simulated to evaluate the performance of SimiNet that is compared with eight state-of-art methods. Results show that SimiNet is able to detect weak spatial variations in compared graphs in addition to computing similarity using both nodes and edges. SimiNet was also applied to real brain networks obtained during a visual recognition task. The algorithm shows high performance to detect spatial variation of brain networks obtained during a naming task of two categories of visual stimuli: animals and tools. A perspective to this work is a better understanding of object categorization in the human brain.
[ { "created": "Thu, 21 Sep 2017 08:38:42 GMT", "version": "v1" } ]
2017-09-22
[ [ "Mheich", "Ahmad", "", "LTSI" ], [ "Hassan", "Mahmoud", "", "LTSI" ], [ "Khalil", "Mohamad", "", "ELEC" ], [ "Gripon", "Vincent", "", "ELEC" ], [ "Dufor", "Olivier", "", "LTSI" ], [ "Wendling", "Fabrice", ...
Quantifying the similarity between two networks is critical in many applications. A number of algorithms have been proposed to compute graph similarity, mainly based on the properties of nodes and edges. Interestingly, most of these algorithms ignore the physical location of the nodes, which is a key factor in the context of brain networks involving spatially defined functional areas. In this paper, we present a novel algorithm called "SimiNet" for measuring similarity between two graphs whose nodes are defined a priori within a 3D coordinate system. SimiNet provides a quantified index (ranging from 0 to 1) that accounts for node, edge and spatiality features. Complex graphs were simulated to evaluate the performance of SimiNet that is compared with eight state-of-art methods. Results show that SimiNet is able to detect weak spatial variations in compared graphs in addition to computing similarity using both nodes and edges. SimiNet was also applied to real brain networks obtained during a visual recognition task. The algorithm shows high performance to detect spatial variation of brain networks obtained during a naming task of two categories of visual stimuli: animals and tools. A perspective to this work is a better understanding of object categorization in the human brain.