- 04 Mar, 2021 1 commit
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Peter Eastman authored
* Replaced several AMOEBA bonded forces with custom forces * Deleted obsolete AMOEBA forces * Replaced AmoebaPiTorsionForce with custom force
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- 09 Apr, 2019 1 commit
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peastman authored
* Created API for HIPPO force field * Beginning of reference implementation of HIPPO * Continuing reference implementation of HIPPO * Continuing reference implementation of HIPPO * Continuing reference implementation of HIPPO * Continuing reference implementation of HIPPO * Continuing reference implementation of HIPPO * Continuing reference implementation of HIPPO * Continuing reference implementation of HIPPO * Completed reference of HIPPO with no cutoff * Beginning cutoffs/PME for reference implementation of HIPPO * Continuing PME for reference implementation of HIPPO * Continuing PME for reference implementation of HIPPO * Continuing PME for reference implementation of HIPPO * Completed reference implementation of HIPPO * Cleanup and optimization to HIPPO reference * Further cleanup to HIPPO * Combined direct space interactions into a single loop * Compute direct space interactions in quasi-internal frame * Beginning of CUDA implementation of HIPPO * Continuing CUDA implementation of HIPPO * Continuing CUDA implementation of HIPPO * Continuing CUDA implementation of HIPPO * Continuing CUDA implementation of HIPPO * Continuing CUDA implementation of HIPPO * Continuing CUDA implementation of HIPPO * Continuing CUDA implementation of HIPPO * Continuing CUDA implementation of HIPPO * Continuing CUDA implementation of HIPPO * Continuing CUDA implementation of HIPPO * Continuing CUDA implementation of HIPPO * Continuing CUDA implementation of HIPPO * Continuing CUDA implementation of HIPPO * Finished CUDA implementation of HIPPO * More features and test cases for HippoNonbondedForce * Serialization and Python API for HippoNonbondedForce * Fixed sign error in computing forces
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- 01 Sep, 2016 1 commit
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Peter Eastman authored
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- 12 Dec, 2013 1 commit
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peastman authored
Plugins work with CPU platform. This involved separating the reference implementations of plugins into their own libraries.
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- 12 Dec, 2012 1 commit
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Peter Eastman authored
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- 14 Oct, 2012 1 commit
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Mark Friedrichs authored
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- 28 Sep, 2012 1 commit
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Peter Eastman authored
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- 27 Sep, 2012 1 commit
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Peter Eastman authored
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- 27 Sep, 2011 1 commit
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Peter Eastman authored
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- 26 Mar, 2011 1 commit
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Peter Eastman authored
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- 11 Mar, 2011 1 commit
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Peter Eastman authored
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- 26 Feb, 2011 1 commit
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Peter Eastman authored
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- 20 Jan, 2011 1 commit
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Mark Friedrichs authored
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- 07 Jan, 2011 1 commit
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Mark Friedrichs authored
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- 10 Nov, 2010 1 commit
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Mark Friedrichs authored
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- 30 Sep, 2010 1 commit
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Mark Friedrichs authored
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- 29 Sep, 2010 1 commit
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Mark Friedrichs authored
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- 22 Sep, 2010 1 commit
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Mark Friedrichs authored
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- 21 Sep, 2010 1 commit
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Mark Friedrichs authored
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- 20 Sep, 2010 2 commits
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Mark Friedrichs authored
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Mark Friedrichs authored
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- 10 Sep, 2010 2 commits
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Mark Friedrichs authored
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Mark Friedrichs authored
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- 08 Sep, 2010 3 commits
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Mark Friedrichs authored
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Mark Friedrichs authored
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Mark Friedrichs authored
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- 24 Aug, 2010 1 commit
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Mark Friedrichs authored
Added checks for nonbonded methods Removed unused functionality from GK force Moved non-accessor methods from Force classes to ForceImpl classes
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- 07 Aug, 2010 1 commit
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Mark Friedrichs authored
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- 27 Jul, 2010 1 commit
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Mark Friedrichs authored
Added export for Windows Format change to accomadate Windows
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- 23 Jul, 2010 1 commit
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Mark Friedrichs authored
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- 22 Jul, 2010 1 commit
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Mark Friedrichs authored
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