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MISATO-dataset
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Adaptability_protein_dynamics
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ce29497
Adaptability_protein_dynamics
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6 contributors
History:
30 commits
stochasticribosome
Add pytraj to requirements
ce29497
almost 2 years ago
code
added requirements
almost 2 years ago
maps
preprocessing for inference (#6)
almost 2 years ago
.gitattributes
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1.48 kB
initial commit
almost 2 years ago
11GS.pdb
Safe
328 kB
scripts from other repo
almost 2 years ago
AmberTools22.tar.bz2
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519 MB
LFS
added ambertools
almost 2 years ago
Dockerfile
723 Bytes
Add AMBER path
almost 2 years ago
MDmodel.py
Safe
1.6 kB
scripts from other repo
almost 2 years ago
README.md
208 Bytes
initial commit
almost 2 years ago
app.py
Safe
5.1 kB
Set white background
almost 2 years ago
best_weights_rep0.pt
Safe
pickle
Detected Pickle imports (4)
"collections.OrderedDict"
,
"torch.LongStorage"
,
"torch._utils._rebuild_tensor_v2"
,
"torch.FloatStorage"
What is a pickle import?
4.52 MB
LFS
scripts from other repo
almost 2 years ago
graph.py
Safe
6.22 kB
scripts from other repo
almost 2 years ago
inference_for_md.hdf5
Safe
61.9 kB
scripts from other repo
almost 2 years ago
main.py
9.51 kB
Fix pdb_file bug
almost 2 years ago
old_main.py
Safe
776 Bytes
container
almost 2 years ago
requirements.txt
66 Bytes
Add pytraj to requirements
almost 2 years ago
transformMD.py
Safe
621 Bytes
scripts from other repo
almost 2 years ago
transforms.py
Safe
2.43 kB
scripts from other repo
almost 2 years ago
