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99aa358fe024a7bf198449eadbd7f2e6da3fa433
rdkit/Code/ForceField/MMFF
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Eisuke Kawashima 77db9ede80 fix doxygen comments (#5254)
2022-07-11 13:55:35 +02:00
..
test_data
- modified Code/GraphMol/AddHs.cpp so that hydrogens are not
2014-02-01 13:05:10 +01:00
AngleBend.cpp
clang-tidy: readability-simplify-boolean-expr (#4639)
2022-03-17 13:50:50 +01:00
AngleBend.h
Run clang-tidy (modernize-use-override) (#4251)
2021-07-01 05:18:56 +02:00
AngleConstraint.cpp
- fixes #3781 (#3975)
2021-03-26 12:53:33 +01:00
AngleConstraint.h
miscellaneous updates (#4284)
2021-07-13 06:57:29 +02:00
BondStretch.cpp
Run clang-format against cpp (#4358)
2021-10-20 04:25:27 +02:00
BondStretch.h
Run clang-tidy (modernize-use-override) (#4251)
2021-07-01 05:18:56 +02:00
CMakeLists.txt
Cleanup some cmake dependencies (#3077)
2020-04-17 14:34:23 +02:00
Contribs.h
Fixes #1903 (#1971)
2018-07-25 09:14:17 +02:00
DistanceConstraint.cpp
Run clang-format against cpp (#4358)
2021-10-20 04:25:27 +02:00
DistanceConstraint.h
Run clang-tidy (modernize-use-override) (#4251)
2021-07-01 05:18:56 +02:00
Nonbonded.cpp
Swap from RDUNUSED_PARAM to unnamed parameters (#4433)
2021-08-24 17:19:46 -04:00
Nonbonded.h
Swap from RDUNUSED_PARAM to unnamed parameters (#4433)
2021-08-24 17:19:46 -04:00
OopBend.cpp
Run clang-format against cpp (#4358)
2021-10-20 04:25:27 +02:00
OopBend.h
Run clang-tidy (modernize-use-override) (#4251)
2021-07-01 05:18:56 +02:00
Params.cpp
Run clang-format against cpp (#4358)
2021-10-20 04:25:27 +02:00
Params.h
fix doxygen comments (#5254)
2022-07-11 13:55:35 +02:00
PositionConstraint.cpp
Run clang-format against cpp (#4358)
2021-10-20 04:25:27 +02:00
PositionConstraint.h
miscellaneous updates (#4284)
2021-07-13 06:57:29 +02:00
StretchBend.cpp
Run clang-format against cpp (#4358)
2021-10-20 04:25:27 +02:00
StretchBend.h
Run clang-tidy (modernize-use-override) (#4251)
2021-07-01 05:18:56 +02:00
testMMFFForceField.cpp
clang-tidy: readability-simplify-boolean-expr (#4639)
2022-03-17 13:50:50 +01:00
testMMFFForceField.h
first pass, using google style
2015-11-14 14:58:11 +01:00
TorsionAngle.cpp
Run clang-format against cpp (#4358)
2021-10-20 04:25:27 +02:00
TorsionAngle.h
Run clang-tidy (modernize-use-override) (#4251)
2021-07-01 05:18:56 +02:00
TorsionConstraint.cpp
- fixes #3781 (#3975)
2021-03-26 12:53:33 +01:00
TorsionConstraint.h
miscellaneous updates (#4284)
2021-07-13 06:57:29 +02:00