Commits · 08f52358a1ec027db4b64b0f32f38542a3e61065 · tsoc / openmm

"...examples/interleave/data/samples_reasoning.jsonl" did not exist on "4b618aa3bab8f4700552f6d600a1e808a4e741a8"

25 Mar, 2010 1 commit
- Reduced number of force buffers for GBSA · 08f52358
  Peter Eastman authored Mar 25, 2010
  
  08f52358
22 Mar, 2010 1 commit
- No commit message · 734d5d67
  Scott Le Grand authored Mar 22, 2010
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No commit message
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  734d5d67
23 Feb, 2010 1 commit
- Bug fix (bug 1051) · 036c3ff4
  Peter Eastman authored Feb 23, 2010
  
  036c3ff4
09 Feb, 2010 1 commit
- Accumulation of Born force was incorrect in USE_OUTPUT_BUFFER_PER_WARP block... · 70099528
  Mark Friedrichs authored Feb 09, 2010
```
Accumulation of Born force was incorrect in USE_OUTPUT_BUFFER_PER_WARP block w/ cell coordinates  x != y
```
  70099528
15 Oct, 2009 1 commit
- Bug fixes to GBSA · d3ec1d0c
  Peter Eastman authored Oct 15, 2009
  
  d3ec1d0c
08 Sep, 2009 1 commit
- Optimizations to PME. · dc677fac
  Peter Eastman authored Sep 08, 2009
  
  dc677fac
03 Sep, 2009 1 commit
- Optimizations to PME direct space calculation. Also added code for PME with GBSA. · 24148147
  Peter Eastman authored Sep 03, 2009
  
  24148147
14 Aug, 2009 1 commit
- Bug fixes to Ewald summation · 8480944d
  Peter Eastman authored Aug 14, 2009
  
  8480944d
11 Aug, 2009 1 commit
- Implemented CUDA calculation for Ewald energy · 12737efd
  Peter Eastman authored Aug 11, 2009
  
  12737efd
08 Aug, 2009 1 commit
- Simplified and optimized calculation of energies · 0541e749
  Peter Eastman authored Aug 08, 2009
  
  0541e749
07 Aug, 2009 1 commit
- All energies existing in Preview Release 3 now run on the GPU, new Ewald... · fdc7cc07
  Kai Kohlhoff authored Aug 07, 2009
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All energies existing in Preview Release 3 now run on the GPU, new Ewald energy terms still use Reference implementation
```
  fdc7cc07
14 May, 2009 1 commit
- Updated license for Cuda platform to LGPL. · 10379a9a
  Peter Eastman authored May 14, 2009
  
  10379a9a
24 Apr, 2009 1 commit
- Optimization: eliminated an unnecessary gpu->cpu data transfer on each time step · c97d5ee1
  Peter Eastman authored Apr 24, 2009
  
  c97d5ee1
02 Apr, 2009 1 commit
- Converted lots of ints to unsigned ints (might help performance a little by avoiding conversions) · 5b017677
  Peter Eastman authored Apr 02, 2009
  
  5b017677
10 Mar, 2009 1 commit
- Implemented finer grained neighbor list. Also various minor optimizations. · e04283fe
  Peter Eastman authored Mar 10, 2009
  
  e04283fe
27 Feb, 2009 1 commit
- Reduced memory use for exclusions. Also deleted some obsolete files. · 8055a541
  Peter Eastman authored Feb 27, 2009
  
  8055a541
20 Feb, 2009 1 commit
- Added other files that somehow got ommitted from earlier checkin · 630bdd40
  Peter Eastman authored Feb 20, 2009
  
  630bdd40