Ecosyste.ms: Repos
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Package Usage: conda: dgllife
Python package for graph neural networks in chemistry and biology
3 versions
Latest release: almost 2 years ago
View more package details: https://packages.ecosyste.ms/registries/anaconda.org/packages/dgllife
View more repository details: https://repos.ecosyste.ms/hosts/GitHub/repositories/awslabs%2Fdgl-lifesci
Dependent Repos 7
anonyanony0/PLDock
Neural Protein Ligand Docking: Dataset and Evaluation- PLDock/models/Equibind/environment.yml
Size: 42.3 MB - Last synced: about 1 year ago - Pushed: over 1 year ago
Yimeng-Wang/JAK-MTATFP
A selective JAK inhibitor screening platform- 0.2.8.* environment.yml
Size: 39 MB - Last synced: over 1 year ago - Pushed: over 2 years ago
Yimeng-Wang/ChemXGNN
- 0.2.8.* environment.yml
Size: 24.9 MB - Last synced: about 1 year ago - Pushed: almost 2 years ago
biolib/app-equibind
Biolib application for EquiBind- equibind/environment.yml
Size: 29.9 MB - Last synced: about 1 year ago - Pushed: almost 2 years ago
amfaber/EquiBind Fork of HannesStark/EquiBind
EquiBind: geometric deep learning for fast predictions of the 3D structure in which a small molecule binds to a protein- environment.yml
Size: 34.1 MB - Last synced: about 1 year ago - Pushed: over 1 year ago
labdao/equibind Fork of HannesStark/EquiBind
EquiBind: geometric deep learning for fast predictions of the 3D structure in which a small molecule binds to a protein- environment.yml
Size: 55.6 MB - Last synced: about 1 year ago - Pushed: about 1 year ago
pranjali-pathre/Equibind-Final
- EquiBind/environment.yml
Size: 34.8 MB - Last synced: about 1 year ago - Pushed: over 1 year ago
pranjali-pathre/EquiBind
- EquiBind/environment.yml
Size: 34.7 MB - Last synced: about 1 year ago - Pushed: over 1 year ago
martinakaduc/SeDok
- environment.yml
Size: 29.4 MB - Last synced: about 1 year ago - Pushed: over 1 year ago
yashjakhotiya/Federated-Learning-on-Molecular-Property-Prediction
- dataset/environment.yml
Size: 132 MB - Last synced: about 1 month ago - Pushed: over 1 year ago
anhnda/D3GlobalBind
- environment.yml
Size: 29.3 MB - Last synced: about 1 year ago - Pushed: over 1 year ago
useCallback/EquiBind Fork of HannesStark/EquiBind
EquiBind: geometric deep learning for fast predictions of the 3D structure in which a small molecule binds to a protein- environment.yml
Size: 29.1 MB - Last synced: 11 months ago - Pushed: about 1 year ago
lifanchen-simm/EquiBind Fork of HannesStark/EquiBind
EquiBind: geometric deep learning for fast predictions of the 3D structure in which a small molecule binds to a protein- environment.yml
Size: 29.1 MB - Last synced: 11 months ago - Pushed: about 2 years ago
BeeBeeWong/AttentiveSkin
Predict Skin Corrosion/Irritation Potential of Chemicals with Explainable Machine Learning- 0.3.2 environment.yml
Size: 9.18 MB - Last synced: 4 months ago - Pushed: 4 months ago