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simonduerr
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diffdock

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1.71 MB

4 contributors

History: 11 commits

Simon Duerr

add init

e23f253 over 3 years ago

baselines
first commit over 3 years ago
confidence
first commit over 3 years ago
data
add protein ligand over 3 years ago
datasets
add init over 3 years ago
esm
fix req, add esm over 3 years ago
examples
gradio update over 3 years ago
models
first commit over 3 years ago
utils
first commit over 3 years ago
visualizations
first commit over 3 years ago
workdir
first commit over 3 years ago
.gitattributes
1.86 kB

add gitlfs over 3 years ago
.gitignore
2.06 kB

fix req, add esm over 3 years ago
LICENSE
1.1 kB

Create LICENSE over 3 years ago
README.md
8.74 kB

add gitlfs over 3 years ago
app.py
15.6 kB

Update app.py over 3 years ago
environment.yml
1.99 kB

first commit over 3 years ago
evaluate.py
35.7 kB

first commit over 3 years ago
evaluate_confidence_calibration.py
27.8 kB

first commit over 3 years ago
inference.py
13.7 kB

first commit over 3 years ago
requirements.txt
498 Bytes

fix req over 3 years ago
train.py
7.67 kB

first commit over 3 years ago