update reference
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app.py
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@@ -34,26 +34,13 @@ st.set_page_config(
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multi-task generalization in various domains, such as personalized federated learning and neural architecture
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search. Especially powerful results were achieved in few- and zero-shot settings, attributed to the increased
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information sharing by the HyperNetwork. With the rise of new diseases fast discovery of drugs is needed which
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requires models that
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In this work, we propose the HyperPCM model, a task-conditioned HyperNetwork approach for the problem of
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predicting drug-target interactions in drug discovery. Our model learns to generate a QSAR model specialized on
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a given protein target. We demonstrate state-of-the-art performance over previous methods on multiple
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well-known benchmarks, particularly in zero-shot settings for unseen protein targets. This app demonstrates the
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model as a retrieval task of the top-k most active drug compounds predicted for a given query target.
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## Citation
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Please cite our work using the following reference.
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"""bibtex
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@article{svensson2024hyperpcm,
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title={{HyperPCM: Robust Task-Conditioned Modeling of Drug--Target Interactions}},
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author={Svensson, Emma and Hoedt, Pieter-Jan and Hochreiter, Sepp and Klambauer, G{\"u}nter},
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journal={Journal of Chemical Information and Modeling},
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publisher={ACS Publications},
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year={2024}
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}
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"""
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'''
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}
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multi-task generalization in various domains, such as personalized federated learning and neural architecture
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search. Especially powerful results were achieved in few- and zero-shot settings, attributed to the increased
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information sharing by the HyperNetwork. With the rise of new diseases fast discovery of drugs is needed which
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requires models that
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In this work, we propose the HyperPCM model, a task-conditioned HyperNetwork approach for the problem of
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predicting drug-target interactions in drug discovery. Our model learns to generate a QSAR model specialized on
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### Citation
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Please cite our work using the following reference.
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@article{svensson2024hyperpcm,
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title={{HyperPCM: Robust Task-Conditioned Modeling of Drug--Target Interactions}},
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author={Svensson, Emma and Hoedt, Pieter-Jan and Hochreiter, Sepp and Klambauer, G{\"u}nter},
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publisher={ACS Publications},
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year={2024}
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}
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"""
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)
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multi-task generalization in various domains, such as personalized federated learning and neural architecture
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search. Especially powerful results were achieved in few- and zero-shot settings, attributed to the increased
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information sharing by the HyperNetwork. With the rise of new diseases fast discovery of drugs is needed which
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requires models that can generalize drug-target interaction predictions in low-data scenarios.
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In this work, we propose the HyperPCM model, a task-conditioned HyperNetwork approach for the problem of
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predicting drug-target interactions in drug discovery. Our model learns to generate a QSAR model specialized on
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a given protein target. We demonstrate state-of-the-art performance over previous methods on multiple
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well-known benchmarks, particularly in zero-shot settings for unseen protein targets. This app demonstrates the
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model as a retrieval task of the top-k most active drug compounds predicted for a given query target.
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'''
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}
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multi-task generalization in various domains, such as personalized federated learning and neural architecture
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search. Especially powerful results were achieved in few- and zero-shot settings, attributed to the increased
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information sharing by the HyperNetwork. With the rise of new diseases fast discovery of drugs is needed which
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+
requires models that can generalize drug-target interaction predictions in low-data scenarios.
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In this work, we propose the HyperPCM model, a task-conditioned HyperNetwork approach for the problem of
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predicting drug-target interactions in drug discovery. Our model learns to generate a QSAR model specialized on
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### Citation
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Please cite our work using the following reference.
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```bibtex
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@article{svensson2024hyperpcm,
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title={{HyperPCM: Robust Task-Conditioned Modeling of Drug--Target Interactions}},
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author={Svensson, Emma and Hoedt, Pieter-Jan and Hochreiter, Sepp and Klambauer, G{\"u}nter},
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publisher={ACS Publications},
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year={2024}
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}
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```
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"""
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)
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