- 13 Jul, 2013 1 commit
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Lee-Ping Wang authored
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- 12 Jul, 2013 6 commits
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Lee-Ping Wang authored
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Peter Eastman authored
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peastman authored
Fixed ACE and NME groups for modeller.
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Lee-Ping Wang authored
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- 11 Jul, 2013 2 commits
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Lee-Ping Wang authored
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Lee-Ping Wang authored
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- 10 Jul, 2013 4 commits
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peastman authored
Fixed an atom ordering bug in AmoebaMultipoleForce
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peastman authored
Install platform specific header files, so plugins can be built without needing a full source tree
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Lee-Ping Wang authored
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Lee-Ping Wang authored
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- 09 Jul, 2013 4 commits
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peastman authored
AmoebaMultipoleForce did not report particle groups, which could potentially lead to incorrect reordering
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https://github.com/SimTk/openmmLee-Ping authored
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https://github.com/SimTk/openmmLee-Ping authored
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Lee-Ping authored
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- 08 Jul, 2013 7 commits
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https://github.com/peastman/openmmPeter authored
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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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Yutong Zhao authored
Workaround for CUDA bug: only enable shuffle optimization on CUDA 5.5 or later
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peastman authored
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peastman authored
Fixed bugs in handling of random numbers in CustomIntegrator (see bug 18...
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https://github.com/SimTk/openmmLee-Ping authored
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https://github.com/SimTk/openmmLee-Ping authored
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- 05 Jul, 2013 6 commits
- 04 Jul, 2013 1 commit
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Robert McGibbon authored
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- 03 Jul, 2013 5 commits
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peastman authored
Add an __all__ to openmm.py so that XXX_swigregister functions don't get imported into python namespace
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Robert McGibbon authored
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Robert McGibbon authored
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peastman authored
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Robert McGibbon authored
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- 01 Jul, 2013 4 commits
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Yutong Zhao authored
Fixed an error when calling acos()
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peastman authored
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Yutong Zhao authored
Created CPU implementation of PME
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Yutong Zhao authored
Disable reaction field when using implicit solvent
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