Commits on Source (47)
-
CallMeKitsu. authored
-
paradoxe-tech authored
-
paradoxe-tech authored
-
paradoxe-tech authored
-
paradoxe-tech authored
-
paradoxe-tech authored
-
paradoxe-tech authored
-
paradoxe-tech authored
-
Kenan Oggad authored
-
Kenan Oggad authored
-
Kenan Oggad authored
-
Kenan Oggad authored
-
paradoxe-tech authored
-
paradoxe-tech authored
-
paradoxe-tech authored
-
paradoxe-tech authored
-
paradoxe-tech authored
-
paradoxe-tech authored
-
paradoxe-tech authored
-
paradoxe-tech authored
-
paradoxe-tech authored
-
Victor ROBERT LAMBRECHT authored
-
Victor ROBERT LAMBRECHT authored
-
Victor ROBERT LAMBRECHT authored
-
paradoxe-tech authored
-
paradoxe-tech authored
-
paradoxe-tech authored
-
paradoxe-tech authored
-
Victor ROBERT LAMBRECHT authored
-
Victor ROBERT LAMBRECHT authored
-
Victor ROBERT LAMBRECHT authored
-
Victor ROBERT LAMBRECHT authored
-
Victor ROBERT LAMBRECHT authored
-
paradoxe-tech authored
-
Victor ROBERT LAMBRECHT authored
-
paradoxe-tech authored
-
Victor ROBERT LAMBRECHT authored
-
paradoxe-tech authored
-
Victor ROBERT LAMBRECHT authored
-
Victor ROBERT LAMBRECHT authored
-
paradoxe-tech authored
-
paradoxe-tech authored
-
paradoxe-tech authored
-
paradoxe-tech authored
-
paradoxe-tech authored
-
paradoxe-tech authored
Showing
- .gitignore 176 additions, 0 deletions.gitignore
- README.md 46 additions, 43 deletionsREADME.md
- env.yaml 29 additions, 0 deletionsenv.yaml
- eval/chemutils.py 12 additions, 0 deletionseval/chemutils.py
- eval/docking.py 65 additions, 0 deletionseval/docking.py
- eval/mutations.py 34 additions, 0 deletionseval/mutations.py
- eval/prepare.py 21 additions, 0 deletionseval/prepare.py
- eval/window.py 51 additions, 0 deletionseval/window.py
- main.py 36 additions, 0 deletionsmain.py
- model/Model.py 256 additions, 0 deletionsmodel/Model.py
- model/featurize.py 50 additions, 0 deletionsmodel/featurize.py
- model/sampler.py 52 additions, 0 deletionsmodel/sampler.py
.gitignore
0 → 100644
env.yaml
0 → 100644
eval/chemutils.py
0 → 100644
eval/docking.py
0 → 100644
eval/mutations.py
0 → 100644
eval/prepare.py
0 → 100644
eval/window.py
0 → 100644
main.py
0 → 100644
model/Model.py
0 → 100644
model/featurize.py
0 → 100644
model/sampler.py
0 → 100644