- 22 May, 2021 1 commit
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Peter Eastman authored
* Began converting AMOEBA to common platform * Beginning of OpenCL platform for AMOEBA * Converted AmoebaVdwForce to common platform * Cleaned up reference AMOEBA tests * Began converting AmoebaMultipoleForce to common platform * Continue converting AmoebaMultipoleForce to common platform * Bug fixes * Bug fix * Continue converting AmoebaMultipoleForce to common platform * Converting AmoebaMultipoleForce and AmoebaGeneralizedKirkwoodForce to common platform * Converting AmoebaMultipoleForce and AmoebaGeneralizedKirkwoodForce to common platform * Creating OpenCL version of AmoebaMultipoleForce and AmoebaGeneralizedKirkwoodForce * Creating OpenCL version of AmoebaMultipoleForce and AmoebaGeneralizedKirkwoodForce * Creating OpenCL version of AmoebaMultipoleForce and AmoebaGeneralizedKirkwoodForce * Converted arrays from real3 to real * Bug fix to OpenCL AmoebaGeneralizedKirkwoodForce * Fixes for AMD GPUs * Began converting HippoNonbondedForce to common platform * Continuing to convert HippoNonbondedForce to common platform * Continuing to convert HippoNonbondedForce to common platform * Working on unifying PME kernels * Fixed error on devices without 64 bit atomics * Unified PME kernels * Converted HippoNonbondedForce to common platform * Creating OpenCL implementation of HippoNonbondedForce * Continuing OpenCL implementation of HippoNonbondedForce * Mostly finished OpenCL implementation of HippoNonbondedForce * Eliminated three component vector types in host code * Fix errors on CPU OpenCL * Skip double precision tests for AMOEBA on OpenCL * Bug fixes * Bug fixes * Fixed compilation error
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- 26 Oct, 2015 1 commit
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Robert T. McGibbon authored
New advanced options OPENMM_BUILD_CPU_TESTS, OPENMM_BUILD_SERIALIZATION_TESTS, OPENMM_BUILD_REFERENCE_TESTS were added to the cmake configuration and disabled in the OpenCL test matrix element to increase speed. Redundant or unnecessary apt packages removed from the travis installation.
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- 27 Aug, 2015 1 commit
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peastman authored
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- 12 Aug, 2015 1 commit
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Peter Eastman authored
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- 03 Nov, 2014 1 commit
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peastman authored
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- 14 Sep, 2014 1 commit
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James Sweet authored
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- 11 Apr, 2014 1 commit
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peastman authored
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- 28 Jan, 2014 1 commit
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Yutong Zhao 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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- 05 Dec, 2013 1 commit
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peastman authored
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- 26 Nov, 2013 1 commit
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peastman authored
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- 12 Dec, 2012 1 commit
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Peter Eastman authored
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- 30 Sep, 2011 1 commit
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Mark Friedrichs authored
TorsionTorsion grids reordered, if needed, so that first angle is the 'slow' index Fixes for MonteCarloBarostat
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- 22 Mar, 2011 1 commit
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Mark Friedrichs authored
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- 28 Feb, 2011 1 commit
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Mark Friedrichs authored
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- 26 Feb, 2011 1 commit
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Peter Eastman authored
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- 18 Jan, 2011 1 commit
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Mark Friedrichs authored
Move install of AmoebaSerialization lib to plugin directory
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- 07 Jan, 2011 1 commit
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Mark Friedrichs authored
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- 26 Oct, 2010 1 commit
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Mark Friedrichs authored
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- 13 Sep, 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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