Commits · 41230a8912fc82ae93d09e1fd457466f7bae1090 · tsoc / openmm

26 Jun, 2018 2 commits
- Bug fix · 41230a89
  Peter Eastman authored Jun 26, 2018
  
  41230a89
- CUDA implementation of parameter offsets for NonbondedForce · 7c6f0b4b
  Peter Eastman authored Jun 26, 2018
  
  7c6f0b4b
25 Jun, 2018 2 commits
- Fixes and minor improvements · 7ebaa816
  Peter Eastman authored Jun 25, 2018
  
  7ebaa816
- OpenCL implementation of parameter offsets for NonbondedForce · 73714806
  peastman authored Jun 25, 2018
  
  73714806
21 Jun, 2018 1 commit
- CPU implementation of parameter offsets for NonbondedForce · 3040bf9d
  peastman authored Jun 21, 2018
  
  3040bf9d
20 Jun, 2018 1 commit
- Reference implementation of parameter offsets for NonbondedForce · 1dd61bab
  peastman authored Jun 20, 2018
  
  1dd61bab
19 Jun, 2018 1 commit
- Merge pull request #2102 from peastman/sort · f9106ddb
  peastman authored Jun 18, 2018
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Fixed race condition in sorting
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  f9106ddb
18 Jun, 2018 3 commits
- Removed unnecessary syncrhonization · 2f565a0d
  Peter Eastman authored Jun 18, 2018
  
  2f565a0d
- Fixed race condition in sorting · 9abaa587
  Peter Eastman authored Jun 18, 2018
  
  9abaa587
- Merge pull request #2101 from peastman/top · ed8a48b6
  peastman authored Jun 18, 2018
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Support more features in Gromacs top files
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  ed8a48b6
15 Jun, 2018 1 commit
- Support more features in Gromacs top files · c30fa8e6
  Peter Eastman authored Jun 15, 2018
  
  c30fa8e6
08 Jun, 2018 3 commits
- Merge pull request #2097 from peastman/membrane · 9dac72f5
  peastman authored Jun 08, 2018
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Fixed problems in adding water with membranes
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  9dac72f5
- Fixed problems in adding water with membranes · 52ddcde3
  peastman authored Jun 08, 2018
  
  52ddcde3
- Merge pull request #2085 from peastman/charges · 73cac8e6
  peastman authored Jun 08, 2018
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Support multiple NonbondedForces in one System 
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  73cac8e6
07 Jun, 2018 1 commit
- Fixes to CPU OpenCL · daa9de8a
  peastman authored Jun 07, 2018
  
  daa9de8a
06 Jun, 2018 2 commits
- ƒixed typo · 82d01134
  peastman authored Jun 06, 2018
  
  82d01134
- Bug fixes · de42858f
  peastman authored Jun 06, 2018
  
  de42858f
30 May, 2018 1 commit
- CPU platform supports multiple NonbondedForces · 402e01b2
  peastman authored May 30, 2018
  
  402e01b2
29 May, 2018 3 commits
- Bug fix · 9c5efe5d
  Peter Eastman authored May 29, 2018
  
  9c5efe5d
- Fixed errors · 95dc4dc1
  Peter Eastman authored May 29, 2018
  
  95dc4dc1
- Support multiple NonbondedForces in one System · 122c84d2
  peastman authored May 29, 2018
  
  122c84d2
23 May, 2018 1 commit
- Merge pull request #2080 from peastman/sphinx · a885a6ae
  peastman authored May 23, 2018
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Changes to work correctly with latest version of Sphinx
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  a885a6ae
22 May, 2018 3 commits
- Changes to work correctly with latest version of Sphinx · 428fb836
  peastman authored May 22, 2018
  
  428fb836
- Merge pull request #2079 from peastman/altloc · 65a1f936
  peastman authored May 22, 2018
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Handle PDB files with altlocs correctly
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  65a1f936
- Handle PDB files with altlocs correctly · d11c2f67
  peastman authored May 22, 2018
  
  d11c2f67
18 May, 2018 1 commit
- Merge pull request #2076 from peastman/patch · 553a96bf
  peastman authored May 18, 2018
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Improved speed of applying patches
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  553a96bf
17 May, 2018 1 commit
- Improved speed of applying patches · 79676986
  peastman authored May 17, 2018
  
  79676986
16 May, 2018 7 commits
- Merge pull request #2073 from peastman/opt · a9d887b3
  peastman authored May 16, 2018
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Minor optimizations
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  a9d887b3
- Merge pull request #2074 from peastman/appveyor · 12b2bac9
  peastman authored May 16, 2018
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Attempt at fixing appveyor
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  12b2bac9
- Merge pull request #2072 from peastman/membrane · 91c8073e
  peastman authored May 16, 2018
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Improvements to building membranes
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  91c8073e
- Attempt at fixing appveyor · 975ca403
  peastman authored May 16, 2018
  
  975ca403
- Minor optimizations · b3af19cd
  peastman authored May 16, 2018
  
  b3af19cd
- Improvements to building membranes · fcee4150
  peastman authored May 16, 2018
  
  fcee4150
- Merge pull request #2068 from peastman/insertion · d03646b5
  peastman authored May 16, 2018
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Preserve PDB insertion codes
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  d03646b5
15 May, 2018 3 commits
- Merge pull request #2066 from jchodera/update-docs · 9a08d9be
  peastman authored May 15, 2018
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Documentation improvements for Amber14 and CHARMM36
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  9a08d9be
- Fix typo · f0e76295
  John Chodera authored May 15, 2018
  
  f0e76295
- Improve error checking · 276e8f4d
  peastman authored May 15, 2018
  
  276e8f4d
14 May, 2018 3 commits
- Modeller handles insertion codes · e4e94dbc
  peastman authored May 14, 2018
  
  e4e94dbc
- Better handle empty insertion codes · 46ee62d9
  peastman authored May 14, 2018
  
  46ee62d9
- Repeat PSF suggestion · b15f87e7
  John Chodera authored May 14, 2018
  
  b15f87e7