Datasets:
Update README.md
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giadefa
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README.md
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@@ -7,6 +7,9 @@ tags:
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- molecular dynamics
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- neural network potential
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pretty_name: 'mdCATH: A Large-Scale MD Dataset for Data-Driven Computational Biophysics'
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---
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@@ -37,5 +40,4 @@ Please cite this manuscript for papers that use the mdCATH dataset:
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| Avg. traj. length | 464 ns |
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| Avg. system size | 2,162 atoms |
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| Avg. domain length | 137 AAs |
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| Total file size | 3.3 TB |
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- molecular dynamics
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- neural network potential
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pretty_name: 'mdCATH: A Large-Scale MD Dataset for Data-Driven Computational Biophysics'
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authors: A. Mirarchi, T. Giorgino and G. De Fabritiis
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size_categories:
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- 10M<n<100M
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---
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| Avg. traj. length | 464 ns |
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| Avg. system size | 2,162 atoms |
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| Avg. domain length | 137 AAs |
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| Total file size | 3.3 TB |
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