- 14 May, 2012 1 commit
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Peter Eastman authored
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- 11 May, 2012 1 commit
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Peter Eastman authored
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- 14 Feb, 2012 2 commits
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Peter Eastman authored
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Peter Eastman authored
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- 02 Feb, 2012 1 commit
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Peter Eastman authored
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- 31 Jan, 2012 1 commit
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Peter Eastman authored
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- 18 Jan, 2012 1 commit
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Peter Eastman authored
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- 15 Dec, 2011 1 commit
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Peter Eastman authored
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- 29 Jun, 2011 1 commit
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Peter Eastman authored
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- 27 Jun, 2011 1 commit
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Peter Eastman authored
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- 12 Aug, 2010 1 commit
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Peter Eastman authored
Refactored ForceImpl, lots of KernelImpl subclasses, and other related classes to avoid redundant calculations when requesting a State with both forces and energies
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- 13 Jul, 2010 1 commit
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Peter Eastman authored
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- 26 May, 2010 1 commit
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Peter Eastman authored
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- 17 May, 2010 1 commit
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Peter Eastman authored
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- 14 May, 2010 1 commit
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Peter Eastman authored
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- 25 Nov, 2009 1 commit
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Peter Eastman authored
Added a version of Platform::getPlatform() that looks up platforms by name. Added a Context constructor that allows platform-specific properties to be specified.
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- 22 Sep, 2009 1 commit
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Peter Eastman authored
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- 19 Sep, 2009 1 commit
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Peter Eastman authored
Restructured how force and energy computations are done to make it easier to write plugins for the CUDA platform
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- 16 Jul, 2009 2 commits
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Peter Eastman authored
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Peter Eastman authored
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- 14 Jul, 2009 1 commit
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Peter Eastman authored
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- 18 Jun, 2009 1 commit
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Peter Eastman authored
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- 21 Apr, 2009 1 commit
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Peter Eastman authored
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- 19 Dec, 2008 1 commit
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Peter Eastman authored
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- 19 Nov, 2008 1 commit
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Peter Eastman authored
Optimization: introduced a kernel to clear forces at the start of each time step rather than relying on the stream
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- 22 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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- 23 Jun, 2008 1 commit
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Christopher Bruns authored
1) Added DLL export macros to many classes; enough to get tests to compile 2) Cosmetic changes to reduce warnings in Visual Studio: a) change many "for (int i ="... to "for (size_t i ="... to avoid unsigned mismatch warnings b) included many explicit static_cast<OpenMMReal>() casts to document places where double->float conversion warnings occur
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- 04 Jun, 2008 1 commit
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Peter Eastman authored
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- 13 May, 2008 1 commit
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Peter Eastman authored
Modified the initialization order of ForceImpls to prevent them from trying to initialize themselves before the Platform had been chosen
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- 02 May, 2008 1 commit
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Peter Eastman authored
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- 25 Apr, 2008 1 commit
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Peter Eastman authored
Continuing to implement ReferencePlatform (implemented kinetic energy calculation and LangevinIntegrator)
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- 17 Apr, 2008 1 commit
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Peter Eastman authored
Created a test case for StandardMMForceFieldImpl's findExclusions() method. Fixed some bugs that it found. Created a CMake script and configured it for building and running test cases.
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- 16 Apr, 2008 1 commit
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Peter Eastman authored
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