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  1. 27 May, 2020 1 commit
  3. 12 Mar, 2020 1 commit
  5. 27 Feb, 2020 2 commits
  7. 08 Jan, 2020 1 commit
    • peastman's avatar
      Common compute framework to unify CUDA and OpenCL code (#2488) · edbc8407
      peastman authored 
      * Began creating common compute framework to unify code between CUDA and OpenCL

* Began OpenCL implementation of common compute framework

* Common implementation of CMMotionRemover

* CUDA implementation of common compute interface

* Converted HarmonicBondForce to common compute API

* Converted standard bonded forces to common compute API

* Converted ExpressionUtilities to common compute API

* Created ComputeParameterSet

* Converted custom bonded forces to common compute API

* Converted CustomCentroidBondForce to common compute API

* Converted CustomManyParticleForce to common compute API

* Moved lots of duplicate code from CudaContext and OpenCLContext to ComputeContext

* Converted GayBerneForce to common compute API

* Removed obsolete kernels

* Converted verlet integrators to common compute API

* Converted Langevin and Brownian integrators to common compute API

* Converted CustomIntegrator to common compute API

* Converted CustomNonbondedForce to common compute API

* Removed uses of a deprecated API

* Fixed failing test cases

* Converted GBSAOBCForce to common compute API

* Began converting CustomGBForce to common compute API

* Finished converting CustomGBForce to common compute API

* Merged duplicated code in CudaIntegrationUtilities and OpenCLIntegrationUtilities

* Converted RMSDForce and AndersenThermostat to common compute API

* Converted CustomHbondForce to common compute API

* Merged scripts for encoding kernel sources

* Converted Drude plugin to common compute API

* Fixed errors in CMake scripts

* Attempt at fixing errors on Windows

* Added discussion of common compute API to developer guide

* Added Windows export macro for common classes

* Fixed error in CMMotionRemover

* Ubdated travis to newer Ubuntu version

* Fixed errors on CPU OpenCL

* Fixed Windows linking errors

* Added missing pragma for 32 bit atomics

* Replaced long long with mm_long

* More fixes to Windows linking

* Bug fix
      edbc8407
  9. 12 Nov, 2019 1 commit
  11. 29 Oct, 2019 1 commit
  13. 25 Oct, 2019 1 commit
  15. 24 Oct, 2019 1 commit
  17. 11 Sep, 2019 1 commit
  19. 15 Oct, 2018 1 commit
  21. 14 Feb, 2018 1 commit
  23. 09 Feb, 2018 1 commit
  25. 24 Mar, 2017 1 commit
  27. 13 Jan, 2017 1 commit
  29. 27 Jun, 2016 1 commit
  31. 18 Jun, 2016 1 commit
  33. 21 Apr, 2016 1 commit
  35. 03 Feb, 2016 1 commit
  37. 26 Oct, 2015 1 commit
    • Robert T. McGibbon's avatar
      Rework .travis.yml to increase speed, especially for OpenCL · 2e3d3de8
      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.
      2e3d3de8
  39. 06 Oct, 2015 1 commit
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  51. 30 Dec, 2014 1 commit
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  59. 14 Jul, 2014 2 commits
  61. 11 Jun, 2014 1 commit
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  67. 09 Jan, 2014 1 commit
  69. 12 Dec, 2013 1 commit
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  75. 13 Nov, 2013 1 commit