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diffdock

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History: 21 commits

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Update esm/scripts/extract.py

d40328c over 2 years ago

baselines
first commit over 2 years ago
confidence
first commit over 2 years ago
data
add protein ligand over 2 years ago
datasets
add init over 2 years ago
esm
Update esm/scripts/extract.py over 2 years ago
examples
gradio update over 2 years ago
models
first commit over 2 years ago
utils
first commit over 2 years ago
visualizations
first commit over 2 years ago
workdir
add lfs models over 2 years ago
.gitattributes

1.86 kB

add gitlfs over 2 years ago
.gitignore

2.06 kB

fix req, add esm over 2 years ago
LICENSE

1.1 kB

Create LICENSE over 2 years ago
README.md

8.74 kB

add gitlfs over 2 years ago
app.py
15.9 kB

Update app.py over 2 years ago
environment.yml

1.99 kB

first commit over 2 years ago
evaluate.py

35.7 kB

first commit over 2 years ago
evaluate_confidence_calibration.py

27.8 kB

first commit over 2 years ago
inference.py

13.7 kB

first commit over 2 years ago
requirements.txt

498 Bytes

fix req over 2 years ago
train.py

7.67 kB

first commit over 2 years ago