Commits · c87fe8a3c6c4a292fad0b1e290ef82f037d9eae5 · tsoc / openmm

19 Feb, 2009 3 commits
- Added changes to get Static libs to work w/ OPENMM_EXPORT setting · c87fe8a3
  Mark Friedrichs authored Feb 19, 2009
  
  c87fe8a3
- If seed <=1, then use time() to generate seed · 84dda6a7
  Mark Friedrichs authored Feb 19, 2009
  
  84dda6a7
- RNG seed mods for LangevinIntegrator · 8c0b4073
  Mark Friedrichs authored Feb 19, 2009
  
  8c0b4073
27 Jan, 2009 1 commit
- Checked in Cuda code · 38f6c8f8
  Peter Eastman authored Jan 27, 2009
  
  38f6c8f8
21 Nov, 2008 1 commit
- Fixed a method that had the wrong return type · 43a4b41f
  Peter Eastman authored Nov 21, 2008
  
  43a4b41f
19 Nov, 2008 2 commits
- Optimization: introduced a kernel to clear forces at the start of each time... · d279014c
  Peter Eastman authored Nov 19, 2008
```
Optimization: introduced a kernel to clear forces at the start of each time step rather than relying on the stream
```
  d279014c
- Modified Cuda and reference platforms to recalculate Born radii every step · b920a178
  Peter Eastman authored Nov 19, 2008
  
  b920a178
18 Nov, 2008 2 commits
- Fixed a test case that was failing, and enhanced several others · 806232c3
  Peter Eastman authored Nov 18, 2008
  
  806232c3
- Constraint tolerance is now adjustable · c4933b5e
  Peter Eastman authored Nov 18, 2008
  
  c4933b5e
17 Nov, 2008 1 commit
- Fixed a few problems related to GBSA · 53f03e6a
  Peter Eastman authored Nov 17, 2008
  
  53f03e6a
16 Nov, 2008 1 commit
- Mods to allow Born radii to be updated if atomic positions updated off the board · 248522cb
  Mark Friedrichs authored Nov 16, 2008
  
  248522cb
14 Nov, 2008 1 commit
- Changed cmake to choose install directory the same way as in SimTKcommon project · f8a19f1e
  Christopher Bruns authored Nov 14, 2008
  
  f8a19f1e
13 Nov, 2008 1 commit
- Increased tolerances on test cases that were failing. · c21572bb
  Peter Eastman authored Nov 13, 2008
  
  c21572bb
12 Nov, 2008 1 commit
- Fixed several bugs in OpenMM · b86e12ce
  Peter Eastman authored Nov 12, 2008
  
  b86e12ce
06 Nov, 2008 1 commit
- Added cmake instructions to install libraries after building · d2638082
  Peter Eastman authored Nov 06, 2008
  
  d2638082
04 Nov, 2008 2 commits
- Look harder for cuda install area on Windows · ff35186f
  Christopher Bruns authored Nov 04, 2008
  
  ff35186f
- Implemented dynamic loading of platforms from DLLs. Also fixed a lot of... · a416009a
  Peter Eastman authored Nov 04, 2008
```
Implemented dynamic loading of platforms from DLLs.  Also fixed a lot of compilation errors and warnings under Windows.
```
  a416009a
31 Oct, 2008 1 commit
- Lots of mystical CMake incantations to make Cuda platform compile both static... · 8f2f6e39
  Peter Eastman authored Oct 31, 2008
```
Lots of mystical CMake incantations to make Cuda platform compile both static and dynamic libraries correctly
```
  8f2f6e39
30 Oct, 2008 1 commit
- Several changes to get OpenMM to build on Linux · 93354c21
  Christopher Bruns authored Oct 30, 2008
```
 * capitalization of gpuTypes.h
 * various cmake issues
```
  93354c21
29 Oct, 2008 2 commits
- Renamed GBSAOBCForceField to GBSAOBCForce. · 3c100e69
  Peter Eastman authored Oct 29, 2008
  
  3c100e69
- Created Cuda implementation of AndersenThermostat. Tweaked test cases for BrownianIntegrator. · 1b2ebaf0
  Peter Eastman authored Oct 29, 2008
  
  1b2ebaf0
28 Oct, 2008 1 commit
- Created Cuda implementation of VerletIntegrator · fc973cdc
  Peter Eastman authored Oct 28, 2008
  
  fc973cdc
27 Oct, 2008 1 commit
- Created Cuda implementation of BrownianIntegrator · 39557436
  Peter Eastman authored Oct 27, 2008
  
  39557436
22 Oct, 2008 2 commits
- Renamed "atoms" to "particles" · 62c4fd53
  Peter Eastman authored Oct 22, 2008
  
  62c4fd53
- Split StandardMMForceField into separate classes for each force term. · ad75a390
  Peter Eastman authored Oct 22, 2008
  
  ad75a390
21 Oct, 2008 1 commit
- Periodic box size is specified with box vectors instead of widths · 8078c417
  Peter Eastman authored Oct 21, 2008
  
  8078c417
20 Oct, 2008 1 commit
- Working on making the GBSA test cases pass · bf9898e6
  Peter Eastman authored Oct 20, 2008
  
  bf9898e6
16 Oct, 2008 1 commit

Changed how kernels get initialized. StandardMMForceField now has you set the... · a138663d

Peter Eastman authored Oct 16, 2008

Changed how kernels get initialized.  StandardMMForceField now has you set the 1-4 interactions explicitly.  CMMotionRemover allows the removal frequency to be set.

a138663d

15 Oct, 2008 1 commit
- Finished incorporating Cuda code into OpenMM · 099b8e55
  Peter Eastman authored Oct 15, 2008
  
  099b8e55
11 Oct, 2008 1 commit
- Incorporating Cuda code into OpenMM · 5c4a033f
  Peter Eastman authored Oct 11, 2008
  
  5c4a033f
24 Sep, 2008 1 commit
- Fixed lots of errors and warnings compiling under Windows · 04ea8ce9
  Peter Eastman authored Sep 24, 2008
  
  04ea8ce9
19 Sep, 2008 1 commit
- Attempting to get Cuda code to compile · 18c9a78a
  Peter Eastman authored Sep 19, 2008
  
  18c9a78a
14 Aug, 2008 1 commit
- Continuing implementation of Cuda platform · ff88ddad
  Peter Eastman authored Aug 14, 2008
  
  ff88ddad
04 Jun, 2008 1 commit
- Began implementing CudaPlatform · 74a8266f
  Peter Eastman authored Jun 04, 2008
  
  74a8266f