DeepRank-GNN

View on PyPIReverse Dependencies (0)

0.1.3 DeepRank_GNN-0.1.3-py3-none-any.whl

Wheel Details

Project: DeepRank-GNN
Version: 0.1.3
Filename: DeepRank_GNN-0.1.3-py3-none-any.whl
Download: [link]
Size: 49362
MD5: b5209141d42c5ae40d62cb5399982724
SHA256: bff01cddf195e8ab3be858f4dab648a5976e368d18eee0076d337a8fe45835ca
Uploaded: 2021-11-16 14:01:46 +0000

dist-info

METADATA

Metadata-Version: 2.1
Name: DeepRank-GNN
Version: 0.1.3
Summary: Graph Neural network Scoring of protein-protein conformations
Author: ['Nicolas Renaud', 'Manon Reau']
Author-Email: n.renaud[at]esciencecenter.nl
Home-Page: https://github.com/DeepRank/DeepRank-GNN
License: Apache Software License 2.0
Keywords: deeprank_gnn
Classifier: Development Status :: 2 - Pre-Alpha
Classifier: Intended Audience :: Developers
Classifier: License :: OSI Approved :: Apache Software License
Classifier: Natural Language :: English
Classifier: Programming Language :: Python :: 3.7
Classifier: Topic :: Scientific/Engineering :: Chemistry
Requires-Dist: numpy (>=1.13)
Requires-Dist: scipy
Requires-Dist: h5py
Requires-Dist: torch (>=1.5.0)
Requires-Dist: networkx
Requires-Dist: matplotlib
Requires-Dist: pdb2sql
Requires-Dist: sklearn
Requires-Dist: chart-studio
Requires-Dist: BioPython
Requires-Dist: python-louvain
Requires-Dist: markov-clustering
Requires-Dist: torch-sparse
Requires-Dist: torch-scatter
Requires-Dist: torch-cluster
Requires-Dist: torch-spline-conv
Requires-Dist: torch-geometric
Requires-Dist: tqdm
Requires-Dist: freesasa
Requires-Dist: prospector[with_pyroma]; extra == "dev"
Requires-Dist: yapf; extra == "dev"
Requires-Dist: isort; extra == "dev"
Requires-Dist: recommonmark; extra == "doc"
Requires-Dist: sphinx; extra == "doc"
Requires-Dist: sphinx-rtd-theme; extra == "doc"
Requires-Dist: coverage; extra == "test"
Requires-Dist: pycodestyle; extra == "test"
Requires-Dist: pytest; extra == "test"
Requires-Dist: pytest-cov; extra == "test"
Requires-Dist: pytest-runner; extra == "test"
Requires-Dist: coveralls; extra == "test"
Provides-Extra: dev
Provides-Extra: doc
Provides-Extra: test
Description-Content-Type: text/markdown
License-File: LICENSE
[Description omitted; length: 4245 characters]

WHEEL

Wheel-Version: 1.0
Generator: bdist_wheel (0.37.0)
Root-Is-Purelib: true
Tag: py3-none-any

RECORD

Path Digest Size
deeprank_gnn/DataSet.py sha256=lI0i_FQvHo_YyXtYSMF8mS7hvbmJUq3BVm6Pr_XxApw 15848
deeprank_gnn/Graph.py sha256=q-SN2_2Ht9EMJSsM6k_gLrrWJpOJSlMhD9rMDhLHNO4 17693
deeprank_gnn/GraphGenMP.py sha256=5TdLO0Ia_2r9ayOqbTe1iAxxApHMYfTXTP__qKYmK-o 6787
deeprank_gnn/Metrics.py sha256=HZs-gp3BT6zFfrhjShIJOcIHwuAiwGAUCqIhtK6D8Sw 9665
deeprank_gnn/NeuralNet.py sha256=lh3hL54b0w39aCFQ6AhoOFlM-jEzE_bbdxf4FbKkhqw 32256
deeprank_gnn/ResidueGraph.py sha256=dnHgi3wdTxGd2uPT8Pnirw44TTVub7Qn4250Wrp9c_c 14274
deeprank_gnn/__init__.py sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU 0
deeprank_gnn/__version__.py sha256=uZsygMXMKRw-7qhWojAjnpm8GFPXU92xW6XA8O5GwFY 22
deeprank_gnn/community_pooling.py sha256=F-Ui6qcfjOEcjlhlWUBDeEl8FJSRxQ5FDFZIH6YF-bo 7822
deeprank_gnn/foutnet.py sha256=-2GG1mACOBLygDTwwzsTFLQCENFKM4h7KE6vq9_k2kw 3661
deeprank_gnn/ginet.py sha256=8CMZGwKV5GpJ9AkCv2ut6hyvKSiVeYre_OXxPF2CnZs 4639
deeprank_gnn/sGAT.py sha256=gf0WGXFL-AXgqhFG4jQGBcAt88efc5dEJwrZkRhBcA4 4327
deeprank_gnn/tools/BSA.py sha256=LagMtMD-Vv9n1XQoPEWQS8o7v6aqpwwIMj61STI75vw 4006
deeprank_gnn/tools/BioWrappers.py sha256=uGmVjBOz9odXmGcP5jbN2AxZHt45C8Pfq1Czz686_SA 1827
deeprank_gnn/tools/CustomizeGraph.py sha256=-KiV5MkRBoR8FyO4pwipZHzP1V1hCtMXUt3xl0paL8o 2225
deeprank_gnn/tools/PSSM.py sha256=Jz-WQcTVi94jy7nsrWC-RTAlcqXay6aoNAanCm8EaVI 1335
deeprank_gnn/tools/__init__.py sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU 0
deeprank_gnn/tools/embedding.py sha256=UKQxU3M2HUHaHNBg9jGg4dMGMeArvJEuzfWDTrt_UKI 566
deeprank_gnn/tools/hdf5_to_csv.py sha256=yozeViaC-_Gy6-mrslpiF_x_0fmjSVYwlJneYBo-SPo 3357
deeprank_gnn/tools/pssm_3dcons_to_deeprank.py sha256=y1P_aN9vbT9dbGWZJo-jH1Rcg-HZ7tYdeRw9ZEZLMlQ 1355
tests/__init__.py sha256=47DEQpj8HBSa-_TImW-5JCeuQeRkm5NMpJWZG3hSuFU 0
tests/test_biowrappers.py sha256=ms_uyJvy34pBam9mPBk4Q8pFtcQNytAtQL0qImTgysM 692
tests/test_bsa.py sha256=BuPUf2HZlZJw6QgtU2S8jU0dbZxleruVNmOmBkh6Mp4 400
tests/test_community_pooling.py sha256=QtqSaUVuvYff-J5hklomLUkT7tg8LfKk99GZ4Ic5OLo 2246
tests/test_create_graph_mp.py sha256=Qgr5Zv7y-eYwsPxugJ-wkY6L9p5kelabJBD9GAzHjPM 1090
tests/test_dataset.py sha256=EJvHuOMfSOrrBForix4coIAt0Fc5B0y-420TwMxM6Lc 1061
tests/test_graph.py sha256=ImCv3cOhgz2QB07_CtZqssgO1oFpZsyWoXImz2igvgg 724
tests/test_nn.py sha256=8DQwBpSF7RpwiAohcM9e5Cmlw9YeKNZYSfTSoUYKszc 1448
tests/test_tools.py sha256=Z_HyVUFsowyhvXsdIgrlYZnXHNmCa2GRSujxfehJ2Fg 1284
tests/utils.py sha256=AV-Tr7HY0881x6DUe1_hOV7x--5D_lNN25fz4n8Wvd8 300
DeepRank_GNN-0.1.3.dist-info/LICENSE sha256=OPzV6bHGPCXFylyiCR3GYAK-EP8seLDbcbgO87DYM1o 11359
DeepRank_GNN-0.1.3.dist-info/METADATA sha256=toySwc-OQqng5jg1Z9JbSLNh88MYIKLVBQ_2hNf3l2s 6043
DeepRank_GNN-0.1.3.dist-info/WHEEL sha256=ewwEueio1C2XeHTvT17n8dZUJgOvyCWCt0WVNLClP9o 92
DeepRank_GNN-0.1.3.dist-info/top_level.txt sha256=6naRZCK13SVuweQUN9f7kLJFFuuUDAoxxtsGURmaN5w 19
DeepRank_GNN-0.1.3.dist-info/RECORD

top_level.txt

deeprank_gnn
tests