- 17 Nov, 2009 2 commits
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Peter Eastman authored
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Peter Eastman authored
Redesigned CustomNonbondedForce to eliminate combining rules and allow the expression to directly use parameters for individual particles.
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- 12 Nov, 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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- 27 Aug, 2009 1 commit
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Peter Eastman authored
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- 24 Aug, 2009 1 commit
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Christopher Bruns authored
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- 11 Aug, 2009 1 commit
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Peter Eastman authored
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- 08 Aug, 2009 1 commit
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Peter Eastman authored
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- 07 Aug, 2009 1 commit
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Kai Kohlhoff authored
All energies existing in Preview Release 3 now run on the GPU, new Ewald energy terms still use Reference implementation
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- 06 Aug, 2009 1 commit
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Peter Eastman authored
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- 17 Jul, 2009 1 commit
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Peter Eastman authored
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- 08 Jul, 2009 1 commit
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Peter Eastman authored
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- 26 Jun, 2009 1 commit
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Peter Eastman authored
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- 24 Jun, 2009 1 commit
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Peter Eastman authored
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- 12 Jun, 2009 1 commit
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Peter Eastman authored
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- 14 May, 2009 1 commit
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Peter Eastman authored
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- 06 May, 2009 1 commit
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Peter Eastman authored
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- 31 Mar, 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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- 19 Feb, 2009 1 commit
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Peter Eastman authored
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- 27 Jan, 2009 1 commit
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Peter Eastman authored
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