Commits · b665dfcb54d2bd2e43eb89647b925af6f9f44d38 · tsoc / openmm

"PyTorch/Compute-Vision/vscode:/vscode.git/clone" did not exist on "7c14c9d1b0d2de4d6f92712c839c912dd5ec815a"

27 Aug, 2015 1 commit
- Python 2/3 compatibility in single code base, plus python 3 testing on travis. · b7088b74
  peastman authored Aug 10, 2015
  
  b7088b74
05 Mar, 2014 1 commit
- Fixed incorrectly formatted comments that caused problems in the API docs · a8a78957
  peastman authored Mar 05, 2014
  
  a8a78957
02 Oct, 2013 4 commits
- same fix about list(quantity) vs quantity(list) for unitcell dimensions · 45f31654
  Robert McGibbon authored Oct 01, 2013
  
  45f31654
- typo: extra s · 7cbc52ed
  Robert McGibbon authored Oct 01, 2013
  
  7cbc52ed
- Bugfix: dms.positions should be a Quantity(list(Vec3)), not a list(Quantity(Vec3)) · ee1323b9
  Robert McGibbon authored Oct 01, 2013
  
  ee1323b9
- Added unittest and 1 system tests. Includes 1 bugfix to resolving a circular... · 552544ab
  Robert McGibbon authored Oct 01, 2013
```
Added unittest and 1 system tests. Includes 1 bugfix to resolving a circular import and 1 bugfix where dms wasn't creating the topology correctly when the water was specified in different chains
```
  552544ab
01 Oct, 2013 5 commits
- Add provenance · 25ac85a4
  Robert McGibbon authored Oct 01, 2013
  
  25ac85a4
- Implement virtualsites and better checking of unsupported params/tables · 5a5d8958
  Robert McGibbon authored Oct 01, 2013
  
  5a5d8958
- intermediate commit, work on virtualsites · 303e0fe3
  Robert McGibbon authored Oct 01, 2013
  
  303e0fe3
- reorder the exclusion before the pair_12_6_es_term so simplify code · 2c83421c
  Robert McGibbon authored Oct 01, 2013
  
  2c83421c
- Simpler use of quantity · 8244403c
  Robert McGibbon authored Oct 01, 2013
  
  8244403c
30 Sep, 2013 1 commit
- Add a reader and createSystem interface for Desmond dms files · ecd87763
  Robert McGibbon authored Sep 30, 2013
  
  ecd87763