| examples/010-single_mol-single_desc.py | 9 | A 0 mins |
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| examples/article/Code5.py | 10 | A 0 mins |
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| docs/scripts/gen_atomic_props.py | 11 | A 0 mins |
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| extra/ci/bump-dev-version.py | 11 | A 0 mins |
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| mordred/_base/pandas_module.py | 12 | A 0 mins |
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| extra/ci/get-rdkit-version.py | 12 | A 0 mins |
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| examples/030-multiple_mol-multiple_desc.py | 13 | A 0 mins |
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| mordred/surface_area/__init__.py | 14 | A 0 mins |
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| mordred/_base/util.py | 16 | A 0 mins |
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| mordred/__init__.py | 19 | A 0 mins |
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| mordred/PBF.py | 20 | A 0 mins |
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| examples/020-single_mol-multiple_desc.py | 20 | A 0 mins |
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| extra/gen_sdf_file.py | 22 | A 0 mins |
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| mordred/McGowanVolume.py | 23 | A 0 mins |
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| mordred/BertzCT.py | 23 | A 0 mins |
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| mordred/BalabanJ.py | 23 | A 0 mins |
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| mordred/descriptors/__init__.py | 28 | A 25 mins |
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| mordred/Aromatic.py | 30 | B 6 hrs |
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| mordred/WienerIndex.py | 31 | A 0 mins |
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| mordred/EccentricConnectivityIndex.py | 31 | A 0 mins |
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| mordred/VertexAdjacencyInformation.py | 32 | A 0 mins |
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| docs/scripts/gen_descriptor_list_xlsx.py | 32 | A 55 mins |
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| mordred/FragmentComplexity.py | 32 | A 0 mins |
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| mordred/SLogP.py | 34 | A 2 hrs |
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| mordred/Weight.py | 34 | A 1 hr |
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| mordred/HydrogenBond.py | 34 | B 5 hrs |
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| mordred/DistanceMatrix.py | 37 | A 2 hrs |
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| mordred/AdjacencyMatrix.py | 37 | A 2 hrs |
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| setup.py | 40 | A 0 mins |
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| mordred/GravitationalIndex.py | 40 | A 1 hr |
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| mordred/surface_area/__main__.py | 41 | A 0 mins |
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| mordred/RotatableBond.py | 41 | A 0 mins |
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| mordred/Polarizability.py | 45 | A 0 mins |
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| mordred/Lipinski.py | 49 | A 0 mins |
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| mordred/MomentOfInertia.py | 49 | A 0 mins |
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| docs/scripts/gen_descriptor_doc.py | 50 | A 0 mins |
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| mordred/LogS.py | 52 | A 0 mins |
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| mordred/Constitutional.py | 53 | A 0 mins |
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| mordred/VdwVolumeABC.py | 55 | A 0 mins |
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| mordred/WalkCount.py | 57 | A 1 hr |
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| mordred/ZagrebIndex.py | 57 | A 0 mins |
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| mordred/ABCIndex.py | 57 | A 2 hrs |
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| mordred/AcidBase.py | 58 | A 0 mins |
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| mordred/Framework.py | 59 | A 30 mins |
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| docs/scripts/gen_default_descs.py | 60 | A 25 mins |
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| mordred/MoRSE.py | 63 | A 0 mins |
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| docs/conf.py | 64 | A 1 hr |
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| mordred/error/__init__.py | 64 | A 0 mins |
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| mordred/_base/parallel.py | 64 | A 1 hr |
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| mordred/_base/context.py | 66 | B 4 hrs |
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