- 11 Dec, 2015 1 commit
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Saurabh Belsare authored
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- 03 Sep, 2015 1 commit
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peastman authored
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- 21 Feb, 2015 1 commit
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peastman authored
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- 08 Feb, 2015 1 commit
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Jason Swails authored
of just 1. Backwards compatibility is provided by making the 2nd force constant default to -1, which is reinterpreted as "copy the first force constant". Updates both the reference and CUDA kernels.
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- 17 Sep, 2014 1 commit
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Christian Schwantes authored
typo fix
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- 17 Oct, 2013 1 commit
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peastman authored
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- 08 Jul, 2013 1 commit
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peastman authored
Platform specific header files get installed. This allows plugins to be built with just an OpenMM installation, not a full source tree.
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- 15 Apr, 2013 1 commit
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Yutong Zhao authored
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- 12 Jan, 2013 2 commits
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Lee-Ping Wang authored
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Lee-Ping Wang authored
Modified the AmoebaMultipoleForce.getSystemMultipoleMoments method with two extra arguments; toggle whether to evaluate energy/force and select maximum multipole order.
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- 21 Nov, 2012 1 commit
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Peter Eastman authored
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- 30 Oct, 2012 1 commit
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Mark Friedrichs authored
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- 14 Oct, 2012 1 commit
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Mark Friedrichs authored
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- 30 Sep, 2012 1 commit
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Mark Friedrichs authored
Modified Reference platform of AmoebaVdwForce to handle PBC, cutoffs, tapering and dispersion correction
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- 28 Sep, 2012 1 commit
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Peter Eastman authored
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- 27 Sep, 2012 1 commit
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Peter Eastman authored
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- 12 Aug, 2012 1 commit
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Mark Friedrichs authored
added tests to TestCudaAmoebaVdwForce for dispersion correction using box of 216 water molecules AmoebaVdwForce and AmoebaMultipoleForce now throw execptions if cutoff > 0.5*(box size)
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- 20 Jun, 2012 1 commit
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Mark Friedrichs authored
Added AmoebaMultipoleForce::getSystemMultipoleMoments() to get system multipole moments; based on TINKER subroutine moments()
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- 15 Jun, 2012 1 commit
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Mark Friedrichs authored
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- 30 Sep, 2011 1 commit
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Mark Friedrichs authored
TorsionTorsion grids reordered, if needed, so that first angle is the 'slow' index Fixes for MonteCarloBarostat
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- 27 Jul, 2011 1 commit
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Mark Friedrichs authored
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- 07 Jan, 2011 1 commit
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Mark Friedrichs authored
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- 05 Jan, 2011 1 commit
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Mark Friedrichs authored
Moved AMOEBA include files to plugins/amoeba/openmmapi/include/openmm to be consistent w/ outlay other plugins, ...
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- 10 Nov, 2010 1 commit
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Mark Friedrichs authored
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- 26 Oct, 2010 1 commit
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Mark Friedrichs authored
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- 30 Sep, 2010 1 commit
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Mark Friedrichs authored
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- 22 Sep, 2010 1 commit
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Mark Friedrichs authored
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- 21 Sep, 2010 1 commit
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Mark Friedrichs authored
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- 20 Sep, 2010 1 commit
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Mark Friedrichs authored
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- 10 Sep, 2010 2 commits
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Mark Friedrichs authored
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Mark Friedrichs authored
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- 08 Sep, 2010 3 commits
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Mark Friedrichs authored
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Mark Friedrichs authored
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Mark Friedrichs authored
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