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Folder: GraphMol
| .. (parent) | ||||
| d | rwxr-xr-x | 30 | Basement | |
| d | rwxr-xr-x | 4,096 | ChemReactions | |
| d | rwxr-xr-x | 4,096 | ChemTransforms | |
| d | rwxr-xr-x | 4,096 | Depictor | |
| d | rwxr-xr-x | 4,096 | Descriptors | |
| d | rwxr-xr-x | 4,096 | DistGeomHelpers | |
| d | rwxr-xr-x | 4,096 | FileParsers | |
| d | rwxr-xr-x | 4,096 | Fingerprints | |
| d | rwxr-xr-x | 79 | ForceFieldHelpers | |
| d | rwxr-xr-x | 4,096 | FragCatalog | |
| d | rwxr-xr-x | 4,096 | MolAlign | |
| d | rwxr-xr-x | 4,096 | MolCatalog | |
| d | rwxr-xr-x | 4,096 | MolChemicalFeatures | |
| d | rwxr-xr-x | 110 | MolDrawing | |
| d | rwxr-xr-x | 4,096 | MolTransforms | |
| d | rwxr-xr-x | 4,096 | PartialCharges | |
| d | rwxr-xr-x | 4,096 | SLNParse | |
| d | rwxr-xr-x | 4,096 | ShapeHelpers | |
| d | rwxr-xr-x | 4,096 | SmilesParse | |
| d | rwxr-xr-x | 4,096 | Subgraphs | |
| d | rwxr-xr-x | 4,096 | Substruct | |
| d | rwxr-xr-x | 4,096 | Wrap | |
| d | rwxr-xr-x | 29 | libs | |
| d | rwxr-xr-x | 29 | testExecs | |
| d | rwxr-xr-x | 4,096 | test_data | |
| - | rw-r--r-- | 24,888 | AddHs.cpp | |
| - | rw-r--r-- | 23,800 | Aromaticity.cpp | |
| - | rw-r--r-- | 17,611 | Atom.cpp | |
| - | rw-r--r-- | 16,916 | Atom.h | |
| - | rw-r--r-- | 17,611 | AtomIterators.cpp | |
| - | rw-r--r-- | 5,599 | AtomIterators.h | |
| - | rw-r--r-- | 6,925 | Bond.cpp | |
| - | rw-r--r-- | 13,565 | Bond.h | |
| - | rw-r--r-- | 3,562 | BondIterators.cpp | |
| - | rw-r--r-- | 2,320 | BondIterators.h | |
| - | rw-r--r-- | 2,936 | CMakeLists.txt | |
| - | rw-r--r-- | 39,039 | Canon.cpp | |
| - | rw-r--r-- | 3,666 | Canon.h | |
| - | rw-r--r-- | 46,113 | Chirality.cpp | |
| - | rw-r--r-- | 891 | Chirality.h | |
| - | rw-r--r-- | 1,674 | Conformer.cpp | |
| - | rw-r--r-- | 3,853 | Conformer.h | |
| - | rw-r--r-- | 6,113 | ConjugHybrid.cpp | |
| - | rw-r--r-- | 44,009 | FindRings.cpp | |
| - | rw-r--r-- | 365 | GraphMol.cpp | |
| - | rw-r--r-- | 452 | GraphMol.h | |
| - | rw-r--r-- | 23,119 | Kekulize.cpp | |
| - | rw-r--r-- | 11,966 | Matrices.cpp | |
| - | rw-r--r-- | 3,699 | MolDiscriminators.cpp | |
| - | rw-r--r-- | 20,309 | MolOps.cpp | |
| - | rw-r--r-- | 29,437 | MolOps.h | |
| - | rw-r--r-- | 56,912 | MolPickler.cpp | |
| - | rw-r--r-- | 6,110 | MolPickler.h | |
| - | rw-r--r-- | 6,640 | MonomerInfo.h | |
| - | rw-r--r-- | 2,382 | PeriodicTable.cpp | |
| - | rw-r--r-- | 11,350 | PeriodicTable.h | |
| - | rw-r--r-- | 5,543 | QueryAtom.cpp | |
| - | rw-r--r-- | 2,697 | QueryAtom.h | |
| - | rw-r--r-- | 6,270 | QueryBond.cpp | |
| - | rw-r--r-- | 2,984 | QueryBond.h | |
| - | rw-r--r-- | 9,659 | QueryOps.cpp | |
| - | rw-r--r-- | 16,722 | QueryOps.h | |
| - | rw-r--r-- | 788 | RDKitBase.h | |
| - | rw-r--r-- | 552 | RDKitQueries.h | |
| - | rw-r--r-- | 18,443 | ROMol.cpp | |
| - | rw-r--r-- | 25,078 | ROMol.h | |
| - | rw-r--r-- | 11,527 | RWMol.cpp | |
| - | rw-r--r-- | 6,856 | RWMol.h | |
| - | rw-r--r-- | 35,651 | RankAtoms.cpp | |
| - | rw-r--r-- | 7,373 | RankAtoms.h | |
| - | rw-r--r-- | 3,480 | Renumber.cpp | |
| - | rw-r--r-- | 3,780 | RingInfo.cpp | |
| - | rw-r--r-- | 4,005 | RingInfo.h | |
| - | rw-r--r-- | 2,927 | Rings.h | |
| - | rw-r--r-- | 939 | SanitException.h | |
| - | rwxr-xr-x | 688 | UnitTestQueryMol.py | |
| - | rw-r--r-- | 90,560 | atomic_data.cpp | |
| - | rw-r--r-- | 2,019 | atomic_data.h | |
| - | rw-r--r-- | 1,854 | bulktest.cpp | |
| - | rw-r--r-- | 2,074 | cptest.cpp | |
| - | rw-r--r-- | 10,382 | itertest.cpp | |
| - | rw-r--r-- | 141,091 | molopstest.cpp | |
| - | rw-r--r-- | 18,795 | querytest.cpp | |
| - | rwxr-xr-x | 52 | regress.txt | |
| - | rw-r--r-- | 2,386 | sanitTest.cpp | |
| - | rw-r--r-- | 31,940 | test1.cpp | |
| - | rw-r--r-- | 5,248 | testCanon.cpp | |
| - | rw-r--r-- | 65,197 | testChirality.cpp | |
| - | rw-r--r-- | 29,685 | testPickler.cpp | |
| - | rwxr-xr-x | 1,878 | test_list.py |
