2b75569a1d6fd36a4ba19404e55f47a2 *DESCRIPTION
861a1ba8711fc04cd1630d79559482d9 *INDEX
22063d748fc4e92aeb520c9bd3ef1a87 *LICENSE
b9a7101cfc1c53adfb037d9e1429f21d *Meta/Rd.rds
8503e676975364d771072956cdbca633 *Meta/features.rds
00d5d7704bc0d4c6c114b42dc7c18818 *Meta/hsearch.rds
22acb5dba6b7c63d036819059071a5cd *Meta/links.rds
a9cfae1ec0129fabde1a03a025d12287 *Meta/nsInfo.rds
2fd5b4ecd7786c87a27116407c59ade0 *Meta/package.rds
12f6bbb3fe490d7cd44b144988490c2b *Meta/vignette.rds
e1f0ba9883e4d6409a777bd7d802cb29 *NAMESPACE
cd38ddb4de0b8157458314e991f9a508 *NEWS.Rd
d6c68f1fe41ced6e98a766a3757313da *R/ChemmineOB
0de49cf5757d715c56e5d91ba8f56c32 *R/ChemmineOB.rdb
a05352d53c2f99d7e260c18172062142 *R/ChemmineOB.rdx
1c9fdc7ce99b34fd6b833e748eba6c4a *doc/ChemmineOB.R
1852f7a928af53d79d88a258679575b3 *doc/ChemmineOB.Rmd
ef381ea77281a35777b89e1db6f4c41f *doc/ChemmineOB.html
5362d261f44c42197e353bf0542d1ff3 *doc/index.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__AliasData-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__DoubleType-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__FastSearch-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__FastSearchIndexer-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__FptIndexHeader-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBAngle-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBAngleData-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBAromaticTyper-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBAtom-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBAtomAtomIter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBAtomBondIter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBAtomClassData-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBAtomTyper-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBBase-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBBitVec-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBBond-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBBuilder-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBChainsParser-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBChiralData-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBCommentData-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBConformerData-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBConversion-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBDOSData-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBDescriptor-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBElectronicTransitionData-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBElement-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBElementTable-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBError-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBExternalBond-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBExternalBondData-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBFFCalculation2-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBFFCalculation3-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBFFCalculation4-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBFFConstraint-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBFFConstraints-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBFFParameter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBFingerprint-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBForceField-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBFormat-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBGenericData-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBGlobalDataBase-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBGridData-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBInternalCoord-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBIsotopeTable-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBMatrixData-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBMessageHandler-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBMol-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBMolAngleIter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBMolAtomBFSIter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBMolAtomDFSIter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBMolAtomIter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBMolBondBFSIter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBMolBondIter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBMolPairIter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBMolRingIter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBMolTorsionIter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBOp-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBOrbital-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBOrbitalData-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBPairData-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBPlugin-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBRTree-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBRandom-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBResidue-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBResidueAtomIter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBResidueData-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBResidueIter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBRing-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBRingData-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBRingSearch-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBRingTyper-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBRotationData-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBSSMatch-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBSerialNums-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBSetData-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBSmartsMatcher-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBSmartsPattern-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBSqrtTbl-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBStopwatch-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBSymmetryData-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBTorsion-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBTorsionData-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBTypeTable-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBUnitCell-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBVectorData-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBVibrationData-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__OBVirtualBond-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__SpaceGroup-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__matrix3x3-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__transform3d-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_OpenBabel__vector3-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_std__pairT_unsigned_int_unsigned_int_t-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_std__vectorT_OpenBabel__OBBond_std__allocatorT_OpenBabel__OBBond_t_t-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_std__vectorT_OpenBabel__OBGenericData_p_std__allocatorT_OpenBabel__OBGenericData_p_t_t-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_std__vectorT_OpenBabel__OBInternalCoord_p_std__allocatorT_OpenBabel__OBInternalCoord_p_t_t-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_std__vectorT_OpenBabel__OBMol_std__allocatorT_OpenBabel__OBMol_t_t-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_std__vectorT_OpenBabel__OBResidue_std__allocatorT_OpenBabel__OBResidue_t_t-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_std__vectorT_OpenBabel__OBRing_p_std__allocatorT_OpenBabel__OBRing_p_t_t-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_std__vectorT_OpenBabel__OBRing_std__allocatorT_OpenBabel__OBRing_t_t-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_std__vectorT_OpenBabel__vector3_std__allocatorT_OpenBabel__vector3_t_t-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_std__vectorT_double_std__allocatorT_double_t_t-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_std__vectorT_int_std__allocatorT_int_t_t-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_std__vectorT_std__pairT_unsigned_int_unsigned_int_t_std__allocatorT_std__pairT_unsigned_int_unsigned_int_t_t_t-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_std__vectorT_std__string_std__allocatorT_std__string_t_t-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_std__vectorT_std__vectorT_int_std__allocatorT_int_t_t_std__allocatorT_std__vectorT_int_std__allocatorT_int_t_t_t_t-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_std__vectorT_unsigned_int_std__allocatorT_unsigned_int_t_t-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+2C_p_stringp-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+3C-+2C_p_OpenBabel__DoubleType-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+3C-+2C_p_OpenBabel__FptIndexHeader-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+3C-+2C_p_OpenBabel__OBAtom-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+3C-+2C_p_OpenBabel__OBAtomAtomIter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+3C-+2C_p_OpenBabel__OBAtomBondIter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+3C-+2C_p_OpenBabel__OBBond-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+3C-+2C_p_OpenBabel__OBFFCalculation2-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+3C-+2C_p_OpenBabel__OBFFCalculation3-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+3C-+2C_p_OpenBabel__OBFFCalculation4-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+3C-+2C_p_OpenBabel__OBFFConstraint-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+3C-+2C_p_OpenBabel__OBFFParameter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+3C-+2C_p_OpenBabel__OBInternalCoord-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+3C-+2C_p_OpenBabel__OBMolAtomBFSIter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+3C-+2C_p_OpenBabel__OBMolAtomDFSIter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+3C-+2C_p_OpenBabel__OBMolAtomIter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+3C-+2C_p_OpenBabel__OBMolBondBFSIter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+3C-+2C_p_OpenBabel__OBMolBondIter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+3C-+2C_p_OpenBabel__OBMolRingIter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+3C-+2C_p_OpenBabel__OBResidueAtomIter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+3C-+2C_p_OpenBabel__OBRing-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+3C-+2C_p_OpenBabel__OBUnitCell-method.html
54a7afb61a727705ed56bd25b23f035e *help/+24+3C-+2C_p_std__pairT_unsigned_int_unsigned_int_t-method.html
54a7afb61a727705ed56bd25b23f035e *help/+5B+2CExternalReference-method.html
54a7afb61a727705ed56bd25b23f035e *help/+5B+3C-+2CExternalReference-method.html
54a7afb61a727705ed56bd25b23f035e *help/+5B+5B+3C-+2C_p_OpenBabel__DoubleType+2Ccharacter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+5B+5B+3C-+2C_p_OpenBabel__FptIndexHeader+2Ccharacter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+5B+5B+3C-+2C_p_OpenBabel__OBAtom+2Ccharacter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+5B+5B+3C-+2C_p_OpenBabel__OBAtomAtomIter+2Ccharacter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+5B+5B+3C-+2C_p_OpenBabel__OBAtomBondIter+2Ccharacter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+5B+5B+3C-+2C_p_OpenBabel__OBBond+2Ccharacter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+5B+5B+3C-+2C_p_OpenBabel__OBFFCalculation2+2Ccharacter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+5B+5B+3C-+2C_p_OpenBabel__OBFFCalculation3+2Ccharacter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+5B+5B+3C-+2C_p_OpenBabel__OBFFCalculation4+2Ccharacter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+5B+5B+3C-+2C_p_OpenBabel__OBFFConstraint+2Ccharacter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+5B+5B+3C-+2C_p_OpenBabel__OBFFParameter+2Ccharacter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+5B+5B+3C-+2C_p_OpenBabel__OBInternalCoord+2Ccharacter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+5B+5B+3C-+2C_p_OpenBabel__OBMolAtomBFSIter+2Ccharacter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+5B+5B+3C-+2C_p_OpenBabel__OBMolAtomDFSIter+2Ccharacter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+5B+5B+3C-+2C_p_OpenBabel__OBMolAtomIter+2Ccharacter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+5B+5B+3C-+2C_p_OpenBabel__OBMolBondBFSIter+2Ccharacter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+5B+5B+3C-+2C_p_OpenBabel__OBMolBondIter+2Ccharacter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+5B+5B+3C-+2C_p_OpenBabel__OBMolRingIter+2Ccharacter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+5B+5B+3C-+2C_p_OpenBabel__OBResidueAtomIter+2Ccharacter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+5B+5B+3C-+2C_p_OpenBabel__OBRing+2Ccharacter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+5B+5B+3C-+2C_p_OpenBabel__OBUnitCell+2Ccharacter-method.html
54a7afb61a727705ed56bd25b23f035e *help/+5B+5B+3C-+2C_p_std__pairT_unsigned_int_unsigned_int_t+2Ccharacter-method.html
177af78bea36bdefc4b66a77fa0814bf *help/AnIndex
fd8f0297abb961efdeb68e1004c90a5a *help/ChemmineOB.rdb
ef59af63d24c05cad6d974291e33bb26 *help/ChemmineOB.rdx
54a7afb61a727705ed56bd25b23f035e *help/OB-classes.html
ef79ed29ed56d7634bcba62842041f1c *help/aliases.rds
6445a219bac316af59f61ee9d6658972 *help/canonicalNumbering_OB.html
7c8dae32489ffd27bcad277f925c3484 *help/convertFormat.html
44b181aad111860c92ac0e94dd7ae537 *help/convertFormatFile.html
ee7ebbfbc81bc3a04fcff7aa7c11bbc2 *help/convertToImage.html
f986000d17a9cd42163a8c0653df8884 *help/exactMass_OB.html
6466978974b65f8e351c954bbbd7698c *help/fingerprint_OB.html
c1aecbd63e22df05d98cc0f2e34a85d4 *help/forEachMol.html
54a7afb61a727705ed56bd25b23f035e *help/length+2CSWIGArray-method.html
37cca69007b972a5e12e9f32a0409ac7 *help/paths.rds
4218b4bc571afa13cf20fa5594c463eb *help/prop_OB.html
2cf5bba161195cfa02963ab4f3f76842 *help/smartsSearch_OB.html
29fca0ddc9cf0e2a7ddf1ed7731db4c0 *html/00Index.html
20ec219e7e5ce637451198b0b16114fa *html/OB-classes.html
b6763e6916890c631fdc3f2643803b1a *html/R.css
eddff97ac5dfbda251d335d307cdc00f *html/canonicalNumbering_OB.html
efec6643f3e3ff724fd3489bf06bff8e *html/convertFormat.html
4643ad0a067fd2093da0c55c26f7ea8b *html/convertFormatFile.html
43276d82887d6a1877e1ff75edccab52 *html/convertToImage.html
a64daaa4de421b10440d9f96439b4ebd *html/exactMass_OB.html
1c84637c33b520a70d689698169ec26f *html/fingerprint_OB.html
2f7ea7e8097c32927906dcc5363a9bfd *html/forEachMol.html
ce4a3c48ac62e98a25303fe0e56eaa96 *html/prop_OB.html
247d48c68c695057af6c5f4a7c534ae2 *html/smartsSearch_OB.html
39e56546c78771f7f1f9f47358dd35e8 *libs/i386/ChemmineOB.dll
28957afc5b69a8a272f324e56c651eb6 *libs/x64/ChemmineOB.dll
7977cc21f976e301066fc7e1a24087bb *openbabel_data/CMakeLists.txt
6e7e46e3ce7697b27bf165c3117676ef *openbabel_data/MACCS.txt
d62b7aac73fb4055dd3f2aeb98dda223 *openbabel_data/SMARTS_InteLigand.txt
bd09cbd61ae3eb71e9c4491a72f980c5 *openbabel_data/UFF.prm
76e15817bceeb0312a39bc55fcbd318e *openbabel_data/aromatic.txt
3196562ddbea37d7c88ee1e352d5262f *openbabel_data/atomtyp.txt
044db1bcdc32a8fd20addbd499af6bd2 *openbabel_data/babel_povray3.inc
b3ed39af82f7e6e505508d4b8569f13e *openbabel_data/bin2hex.pl
e9e9d05957a0205eb4c79b29d4b1dee7 *openbabel_data/bondtyp.txt
6a267107c07c4c92a1be40c2fdf6d21c *openbabel_data/element.txt
b4ad971813d73c3f73dcaf942e74fbb9 *openbabel_data/fragments.txt
4944b8d67de5fee96bb0857d34aac376 *openbabel_data/gaff.dat
0d876fe9f6830cd92973d99d982d3efb *openbabel_data/gaff.prm
e447e65119abb7d678c9549206af8cc5 *openbabel_data/genheaders.sh
017288da0b33b5ac031c3519ab5695aa *openbabel_data/ghemical.prm
e745bff36a346d8f38b022654088b394 *openbabel_data/isotope-small.txt
e296716878102a6d7dcf05570f74a2d9 *openbabel_data/isotope.txt
2c57c871779ca051278202fc1ecf3bfd *openbabel_data/logp.txt
66f6f3c5c4068ef6841ff00f478561d7 *openbabel_data/mm2.prm
be5ff522617dea390361248f16a94091 *openbabel_data/mmff94.ff
2bbe89709f675596f1317b410a8d8040 *openbabel_data/mmff94s.ff
3ec8373f19462004155dce347c5a3a62 *openbabel_data/mmffang.par
2550d2b99e29f0069ea9b484704c12cf *openbabel_data/mmffbndk.par
6b746d9c565acd317f624b3965e86ac5 *openbabel_data/mmffbond.par
ee54141fedff2c456480ef13a32b35d3 *openbabel_data/mmffchg.par
6f0bcd30e4d2c039ba1ea417da5008cd *openbabel_data/mmffdef.par
54b36ddafa1e88c9b5b0042bee002f5a *openbabel_data/mmffdfsb.par
35e25b2bf875e6885b8c382119e33614 *openbabel_data/mmffoop.par
e52850fe6fe124d25b8ee130afb9164e *openbabel_data/mmffpbci.par
54be23e685e2768124bc0b6c2f32d654 *openbabel_data/mmffprop.par
d3ececbdd4eaac1f5bc662967f34cfca *openbabel_data/mmffs_oop.par
57465326131ae3aabec0a6d6c1be8133 *openbabel_data/mmffs_tor.par
e73d625bf9eca7444593392bcd79bbb8 *openbabel_data/mmffstbn.par
b620e7845df83c55a2672b27fdf71f78 *openbabel_data/mmfftor.par
d976d5a602b278fbc215a51260ad3643 *openbabel_data/mmffvdw.par
10b08da9d73604edf86ce1d52fc46600 *openbabel_data/mpC.txt
88bbaf8ed6e2bd380ba72bf1623dc706 *openbabel_data/mr.txt
f85f7071ed6b827d3556cf3bbfbb8cb3 *openbabel_data/patterns.txt
1f3ec77176601a2aa650fdfbd98ed28b *openbabel_data/phmodel.txt
eb8c0673c4975081b3f54aa1d5e51667 *openbabel_data/plugindefines.txt
b04f2b597cc496abebab0624e893ffba *openbabel_data/psa.txt
1a5a5b850c3fbbe8cac3e41fa6e56ea5 *openbabel_data/qeq.txt
0ddc021f6a63b15448b5d344f8b069c1 *openbabel_data/resdata.txt
bdc5ee07b21662173b30c0af388b86bf *openbabel_data/ringtyp.txt
8caa5f69721cc18746ae1cddcd87e25e *openbabel_data/space-groups.txt
eef3bcc25e500b0aff427b88108105d5 *openbabel_data/space-groups.xsl
7cd7574162bd11a439a876e9739e01db *openbabel_data/splash.png
c80caac0bb2878dcbd25af043f3bb4dc *openbabel_data/superatom.txt
69a30183e5762fba8db7dd083216db01 *openbabel_data/svgformat.script
37ad4cc1f246207912cbcaeddcf258ee *openbabel_data/templates.sdf
94bb63776410d9cebc54e6e3009a3957 *openbabel_data/torlib.txt
4fb75615acc82abcca77e4c8f63bd639 *openbabel_data/types.txt
d162ed9371c2d5249571e816c496ece1 *unitTests/test_conversions.R
3101d25f93c0d91637c4fa6e2f4d8033 *unitTests/test_main.R
