Commits · a409f0e8c14898474dcabf3f1c5caabac9c45d4f · tsoc / openmm

13 Jun, 2009 1 commit

In calcForces() kReduceBornSumAndForces kernel is not needed since Born... · 3007cf52

Mark Friedrichs authored Jun 13, 2009

In calcForces() kReduceBornSumAndForces kernel is not needed since Born radii/Obc chain term now calculated prior to calculation of forces
Modified kCalculateObcGbsaBornSum kernel loop to match that in kCalculateCDLJObcGbsaForces1; Born sums are zero w/o mods

3007cf52

14 May, 2009 1 commit
- Updated license for Cuda platform to LGPL. · 10379a9a
  Peter Eastman authored May 14, 2009
  
  10379a9a
24 Apr, 2009 1 commit
- Optimization: eliminated an unnecessary gpu->cpu data transfer on each time step · c97d5ee1
  Peter Eastman authored Apr 24, 2009
  
  c97d5ee1
02 Apr, 2009 1 commit
- Converted lots of ints to unsigned ints (might help performance a little by avoiding conversions) · 5b017677
  Peter Eastman authored Apr 02, 2009
  
  5b017677
10 Mar, 2009 1 commit
- Implemented finer grained neighbor list. Also various minor optimizations. · e04283fe
  Peter Eastman authored Mar 10, 2009
  
  e04283fe
20 Feb, 2009 1 commit
- Added other files that somehow got ommitted from earlier checkin · 630bdd40
  Peter Eastman authored Feb 20, 2009
  
  630bdd40