Commits · 0b662b4991e37286331dd4b5755d53f2b79fd1dd · tsoc / openmm

16 May, 2008 2 commits
- Implemented center of mass motion removal for OpenMM · 0b662b49
  Peter Eastman authored May 16, 2008
  
  0b662b49
- Modified OpenMM to use nm and kJ as units instead of angstroms and kcal · 07adfcbc
  Peter Eastman authored May 16, 2008
  
  07adfcbc
14 May, 2008 1 commit

Added 'return platform' to registerReferencePlatform() -- VisualStudio... · 9f0086f3

Mark Friedrichs authored May 14, 2008

Added 'return platform' to registerReferencePlatform() -- VisualStudio complained about no return value
Added #include "../sfmt/SFMT.h" to SimTKOpenMMUtilities.h to get 'uint32_t' declaration

9f0086f3

13 May, 2008 1 commit

Modified the initialization order of ForceImpls to prevent them from trying to... · 3d750e85

Peter Eastman authored May 13, 2008

Modified the initialization order of ForceImpls to prevent them from trying to initialize themselves before the Platform had been chosen

3d750e85

02 May, 2008 1 commit
- Created reference implementation of AndersenThermostat · a5288d55
  Peter Eastman authored May 02, 2008
  
  a5288d55
29 Apr, 2008 3 commits
- Created reference implementation of VerletIntegrator · f14182c5
  Peter Eastman authored Apr 29, 2008
  
  f14182c5
- Created reference implementation of BrownianIntegrator · 5c4be2f0
  Peter Eastman authored Apr 29, 2008
  
  5c4be2f0
- Continuing to implement ReferencePlatform (implemented GBSA kernels, added... · 2cfc6821
  Peter Eastman authored Apr 29, 2008
```
Continuing to implement ReferencePlatform (implemented GBSA kernels, added test case for SHAKE and fixed some bugs in it)
```
  2cfc6821
26 Apr, 2008 1 commit
- Initial checkin · 5d9ae810
  Mark Friedrichs authored Apr 26, 2008
  
  5d9ae810
25 Apr, 2008 4 commits
- Moved obsolete GBSA reference code back to where it was before · 45ed59f8
  Peter Eastman authored Apr 25, 2008
  
  45ed59f8
- Moved GBSA reference code into the reference platform directory · f3e77e33
  Peter Eastman authored Apr 25, 2008
  
  f3e77e33
- Added SFMT as a random number generator for the reference platform. · 0aad1354
  Peter Eastman authored Apr 25, 2008
  
  0aad1354
- Continuing to implement ReferencePlatform (implemented kinetic energy... · 85da5e0f
  Peter Eastman authored Apr 25, 2008
```
Continuing to implement ReferencePlatform (implemented kinetic energy calculation and LangevinIntegrator)
```
  85da5e0f
23 Apr, 2008 1 commit
- Deleted duplicate files created through an error in Subversion · e89c2e64
  Peter Eastman authored Apr 23, 2008
  
  e89c2e64
22 Apr, 2008 1 commit
- Continuing to implement ReferencePlatform (kernels for StandardMMForceField are done). · 2a530882
  Peter Eastman authored Apr 22, 2008
  
  2a530882
19 Apr, 2008 1 commit
- Continuing to implement ReferencePlatform · 012b28e6
  Peter Eastman authored Apr 19, 2008
  
  012b28e6
18 Apr, 2008 1 commit
- Began implementing ReferencePlatform · e561a678
  Peter Eastman authored Apr 18, 2008
  
  e561a678
17 Apr, 2008 4 commits
- Moving the reference code into the platforms folder · 598e076c
  Peter Eastman authored Apr 17, 2008
  
  598e076c
- Moving the reference code into the platforms folder · 76e2849c
  Peter Eastman authored Apr 17, 2008
  
  76e2849c
- Created folders for reference platform · ae4c6f96
  Peter Eastman authored Apr 17, 2008
  
  ae4c6f96
- Created a test case for StandardMMForceFieldImpl's findExclusions() method. ... · 27a2456b
  Peter Eastman authored Apr 17, 2008
```
Created a test case for StandardMMForceFieldImpl's findExclusions() method.  Fixed some bugs that it found.  Created a CMake script and configured it for building and running test cases.
```
  27a2456b
16 Apr, 2008 2 commits
- Reorganization of the OpenMM source code · 6ddebdb2
  Peter Eastman authored Apr 16, 2008
  
  6ddebdb2
- Reorganization of the OpenMM source code · 0e879806
  Peter Eastman authored Apr 16, 2008
  
  0e879806
15 Apr, 2008 3 commits
- Create OpenMM/platforms directory · 949599de
  Christopher Bruns authored Apr 15, 2008
  
  949599de
- Create OpenMM/tests directory · a0ebf433
  Christopher Bruns authored Apr 15, 2008
  
  a0ebf433
- Create OpenMM directory under trunk · 1fdf9173
  Christopher Bruns authored Apr 15, 2008
  
  1fdf9173