- 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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- 22 Mar, 2013 1 commit
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Peter Eastman authored
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- 03 Jan, 2011 1 commit
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Peter Eastman authored
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- 21 Jul, 2010 1 commit
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Peter Eastman authored
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- 18 Dec, 2009 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
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- 03 Nov, 2009 1 commit
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Mark Friedrichs authored
Free energy plugin added Plugin will not run w/ Obc or GB/VI forces unless line 2004 of gpu.cpp (gpu->sim.totalNonbondOutputBuffers = 2*gpu->sim.nonbondOutputBuffers;) is commented in -- working on removing this constraint Also unit tests for GB/VI currently fail
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- 31 Jul, 2009 1 commit
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Mark Friedrichs authored
Forced computation of dot product used in computing angles to be done in double precision; acos() is very steep for angles near pi and single precison was giving disagreement w/ corresponding Gromacs values (discrepancies of the order of ~1.0)
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- 19 Apr, 2008 1 commit
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Peter Eastman authored
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- 18 Apr, 2008 1 commit
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Peter Eastman authored
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- 17 Apr, 2008 1 commit
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Peter Eastman authored
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