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Author:
None
License:
Copyright (c) 2020 Acellera
Permission is hereby granted, free of charge, to any person obtaining a copy of this software and associated documentation files (the "Software"), to deal ...
Summary:
TorchMD. Molecular dynamics with pytorch
Latest version:
1.1.2
Required dependencies:
pyyaml
|
torch
|
tqdm
Optional dependencies:
moleculekit
|
networkx
|
numpy
|
pandas
|
parmed
|
scipy
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