├── .gitignore ├── analysis ├── Draw │ ├── MolDrawing.py │ ├── __init__.py │ └── mplCanvas.py ├── lrp.py └── scatterplot.py ├── model ├── dataset.py ├── layers.py ├── models.py └── trainer.py └── script └── InteractionNet.py /.gitignore: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/blackmints/InteractionNet/HEAD/.gitignore -------------------------------------------------------------------------------- /analysis/Draw/MolDrawing.py: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/blackmints/InteractionNet/HEAD/analysis/Draw/MolDrawing.py -------------------------------------------------------------------------------- /analysis/Draw/__init__.py: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/blackmints/InteractionNet/HEAD/analysis/Draw/__init__.py -------------------------------------------------------------------------------- /analysis/Draw/mplCanvas.py: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/blackmints/InteractionNet/HEAD/analysis/Draw/mplCanvas.py -------------------------------------------------------------------------------- /analysis/lrp.py: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/blackmints/InteractionNet/HEAD/analysis/lrp.py -------------------------------------------------------------------------------- /analysis/scatterplot.py: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/blackmints/InteractionNet/HEAD/analysis/scatterplot.py -------------------------------------------------------------------------------- /model/dataset.py: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/blackmints/InteractionNet/HEAD/model/dataset.py -------------------------------------------------------------------------------- /model/layers.py: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/blackmints/InteractionNet/HEAD/model/layers.py -------------------------------------------------------------------------------- /model/models.py: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/blackmints/InteractionNet/HEAD/model/models.py -------------------------------------------------------------------------------- /model/trainer.py: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/blackmints/InteractionNet/HEAD/model/trainer.py -------------------------------------------------------------------------------- /script/InteractionNet.py: -------------------------------------------------------------------------------- https://raw.githubusercontent.com/blackmints/InteractionNet/HEAD/script/InteractionNet.py --------------------------------------------------------------------------------