[sire] r2769 committed - gradient is calculated per block and not as cumulative gradient - upda...
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si...@googlecode.com
Feb 25, 2015, 5:14:40 PM2/25/15
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Revision: 2769
Author: nivi...@googlemail.com
Date: Wed Feb 25 22:14:13 2015 UTC
Log: gradient is calculated per block and not as cumulative gradient -
update interface
https://code.google.com/p/sire/source/detail?r=2769
Modified:
/python/branches/users/nividic/Move/OpenMMFrEnergyST.pypp.cpp
/python/branches/users/nividic/Move/SireMove_registrars.cpp
Author: nivi...@googlemail.com
Date: Wed Feb 25 22:14:13 2015 UTC
Log: gradient is calculated per block and not as cumulative gradient -
update interface
https://code.google.com/p/sire/source/detail?r=2769
Modified:
/python/branches/users/nividic/Move/OpenMMFrEnergyST.pypp.cpp
/python/branches/users/nividic/Move/SireMove_registrars.cpp
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