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2a754639594a94de64080795b6cb72b942911101
rdkit
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ForceField
History
Greg Landrum
5618819c64
merge
#641
2015-11-14 05:03:24 +01:00
..
MMFF
Switches to URANGE_CHECK when appropriate
2015-10-18 21:14:02 -04:00
UFF
Switches to URANGE_CHECK when appropriate
2015-10-18 21:14:02 -04:00
Wrap
Suppresses Boost warnings
2015-10-18 13:41:03 -04:00
CMakeLists.txt
- added relative DistanceConstraints (i.e., +/- with respect
2013-12-02 19:58:29 +01:00
Contrib.h
fixes based on code review
2015-10-21 14:51:53 +02:00
ForceField.cpp
Switches to URANGE_CHECK when appropriate
2015-10-18 21:14:02 -04:00
ForceField.h
support copying ForceField objects
2015-03-11 03:06:32 +01:00