MANIFEST.in
README.md
setup.py
kgcnn/__init__.py
kgcnn.egg-info/PKG-INFO
kgcnn.egg-info/SOURCES.txt
kgcnn.egg-info/dependency_links.txt
kgcnn.egg-info/requires.txt
kgcnn.egg-info/top_level.txt
kgcnn/data/__init__.py
kgcnn/data/base.py
kgcnn/data/tudataset.py
kgcnn/data/datasets/ESOL.py
kgcnn/data/datasets/PROTEINS.py
kgcnn/data/datasets/__init__.py
kgcnn/data/datasets/cora.py
kgcnn/data/datasets/cora_lu.py
kgcnn/data/datasets/lipop.py
kgcnn/data/datasets/mutag.py
kgcnn/data/datasets/mutagenicity.py
kgcnn/data/datasets/qm9.py
kgcnn/layers/README.md
kgcnn/layers/__init__.py
kgcnn/layers/attention.py
kgcnn/layers/base.py
kgcnn/layers/blocks.py
kgcnn/layers/casting.py
kgcnn/layers/connect.py
kgcnn/layers/conv.py
kgcnn/layers/embedding.py
kgcnn/layers/gather.py
kgcnn/layers/geom.py
kgcnn/layers/haste.py
kgcnn/layers/interaction.py
kgcnn/layers/keras.py
kgcnn/layers/mlp.py
kgcnn/layers/pooling.py
kgcnn/layers/set2set.py
kgcnn/layers/sparse.py
kgcnn/layers/topk.py
kgcnn/layers/update.py
kgcnn/literature/AttentiveFP.py
kgcnn/literature/DimeNetPP.py
kgcnn/literature/GAT.py
kgcnn/literature/GATv2.py
kgcnn/literature/GCN.py
kgcnn/literature/GIN.py
kgcnn/literature/GNNExplain.py
kgcnn/literature/GraphSAGE.py
kgcnn/literature/INorp.py
kgcnn/literature/Megnet.py
kgcnn/literature/NMPN.py
kgcnn/literature/PAiNN.py
kgcnn/literature/Schnet.py
kgcnn/literature/Unet.py
kgcnn/literature/__init__.py
kgcnn/mol/__init__.py
kgcnn/mol/methods.py
kgcnn/mol/molgraph.py
kgcnn/ops/__init__.py
kgcnn/ops/activ.py
kgcnn/ops/casting.py
kgcnn/ops/initializer.py
kgcnn/ops/partition.py
kgcnn/ops/polynom.py
kgcnn/ops/ragged.py
kgcnn/ops/scatter.py
kgcnn/ops/segment.py
kgcnn/ops/sorting.py
kgcnn/utils/__init__.py
kgcnn/utils/adj.py
kgcnn/utils/data.py
kgcnn/utils/learning.py
kgcnn/utils/loader.py
kgcnn/utils/loss.py
kgcnn/utils/models.py
test/test_BesselBasisLayers.py
test/test_GatherNodes_ragged.py
test/test_SphericalBasisLayer.py
test/test_adjpower.py
test/test_attention_disjoint.py
test/test_find_angle_pairs.py
test/test_pooling_LSTM_disjoint.py
test/test_topk_disjoint.py
test/test_topk_ragged.py