Commits · 346d3ce3244e9af797a12002ced79cbcb5190a5b · tsoc / openmm

29 Jul, 2025 1 commit
- Tentative new structure for examples directory · 346d3ce3
  Evan Pretti authored Jul 29, 2025
  
  346d3ce3
05 May, 2025 1 commit
- Copy water models from Amber14 to Amber 19 and update paths · 94e0853a
  Evan Pretti authored May 05, 2025
  
  94e0853a
02 May, 2025 1 commit
- Add amber19-all, update documentation and tests · a4f8921d
  Evan Pretti authored May 02, 2025
  
  a4f8921d
10 Mar, 2025 1 commit
- Examples use DCDReporter instead of PDBReporter (#4838) · 7bdf028c
  Peter Eastman authored Mar 10, 2025
  
  7bdf028c
01 Feb, 2021 1 commit

Top level Python module is now "openmm" (#3000) · e53bdc5e

Peter Eastman authored Feb 01, 2021

* Top level Python module is now "openmm"

* Updated module names in examples

* Updated module names in documentation

* Updated module in CI scripts

* Added deprecation warning

e53bdc5e

14 Feb, 2020 1 commit
- Renamed BAOABLangevinIntegrator to LangevinMiddleIntegrator · 65ee8fd7
  Peter Eastman authored Feb 14, 2020
  
  65ee8fd7
17 Jan, 2020 1 commit
- Updated simulation parameters in documentation and examples · ad35dab4
  peastman authored Jan 17, 2020
  
  ad35dab4
21 Oct, 2019 1 commit
- Updated documentation and examples to include BAOABLangevinIntegrator · e1aec292
  peastman authored Oct 21, 2019
  
  e1aec292
28 Nov, 2017 1 commit
- Added new Amber and CHARMM force fields · 9d9a3f4f
  peastman authored Nov 28, 2017
  
  9d9a3f4f
24 Apr, 2012 1 commit
- Added a StateDataReporter to the Python examples · 7a45cf24
  Peter Eastman authored Apr 24, 2012
  
  7a45cf24
03 Jan, 2012 1 commit
- Python examples only simulate 10,000 time steps instead of 100,000 · 3eff31f2
  Peter Eastman authored Jan 03, 2012
  
  3eff31f2
18 Nov, 2011 1 commit
- Added examples for app · 534fd404
  Peter Eastman authored Nov 18, 2011
  
  534fd404