- 01 Apr, 2010 1 commit
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Peter Eastman authored
All platforms now handle nonbonded exceptions in a consistent way (they ignore cutoffs and periodic boundary conditions). Also started OpenCL implementation of CustomHbondForce.
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- 06 Feb, 2010 1 commit
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Peter Eastman authored
Increased the tolerance on two tests that started failing when we switched the reference platform to double precision
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- 13 Jan, 2010 1 commit
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Peter Eastman authored
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- 11 Dec, 2009 1 commit
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Peter Eastman authored
Use a consistent (and more accurate) value for electric constant everywhere. Also cleaned up handling of constants and units in various places.
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- 08 Oct, 2009 1 commit
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Peter Eastman authored
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- 06 Oct, 2009 2 commits
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Peter Eastman authored
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Peter Eastman authored
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- 01 Oct, 2009 2 commits
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Peter Eastman authored
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Peter Eastman authored
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- 21 Sep, 2009 1 commit
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Rossen Apostolov authored
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- 12 Sep, 2009 1 commit
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Peter Eastman authored
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- 19 Aug, 2009 1 commit
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Peter Eastman authored
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- 11 Aug, 2009 1 commit
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Peter Eastman authored
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- 14 Jul, 2009 2 commits
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Peter Eastman authored
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Peter Eastman authored
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- 02 Jul, 2009 1 commit
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Peter Eastman authored
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- 15 May, 2009 1 commit
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Rossen Apostolov authored
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- 04 May, 2009 1 commit
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Michael Sherman authored
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- 21 Apr, 2009 1 commit
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Peter Eastman authored
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- 17 Apr, 2009 2 commits
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Peter Eastman authored
Modified the API for lots of classes so that the number of particles/bonds/etc. need not be specified in the constructor.
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Peter Eastman authored
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- 08 Apr, 2009 1 commit
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Peter Eastman authored
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- 24 Mar, 2009 1 commit
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Peter Eastman authored
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- 10 Mar, 2009 1 commit
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Peter Eastman authored
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- 19 Feb, 2009 1 commit
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Peter Eastman authored
Checked in explicit solvent implementation for Cuda platform (cutoffs, periodic boundary conditions, SETTLE)
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- 22 Oct, 2008 2 commits
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Peter Eastman authored
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Peter Eastman authored
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- 21 Oct, 2008 1 commit
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Peter Eastman authored
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- 16 Oct, 2008 1 commit
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Peter Eastman authored
Changed how kernels get initialized. StandardMMForceField now has you set the 1-4 interactions explicitly. CMMotionRemover allows the removal frequency to be set.
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- 11 Oct, 2008 1 commit
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Peter Eastman authored
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- 18 Jul, 2008 1 commit
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Peter Eastman authored
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- 12 Jul, 2008 1 commit
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Peter Eastman authored
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- 22 Apr, 2008 1 commit
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Peter Eastman authored
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