File | Last Change |
---|---|
../ | |
selection/ | 2759 (18 years ago) by tim: Adding single precision capabilities to c++ side |
antlr/ | 2970 (18 years ago) by gezelter: starting change of file formats |
profiling/ | 3342 (16 years ago) by gezelter: updating configure process |
restraints/ | 3342 (16 years ago) by gezelter: updating configure process |
constraints/ | 3342 (16 years ago) by gezelter: updating configure process |
minimizers/ | 3432 (16 years ago) by gezelter: Changes for implementing Amber force field: Added Inversions and worked on BaseAtomTypes so that they'd function with the fortran side. |
mdParser/ | 3432 (16 years ago) by gezelter: Changes for implementing Amber force field: Added Inversions and worked on BaseAtomTypes so that they'd function with the fortran side. |
lattice/ | 3446 (16 years ago) by cli2: Inversion fixes and amber mostly working |
visitors/ | 3448 (16 years ago) by gezelter: Added some logic to print out a special pair distance as a column in the stat file. To use this feature, use taggedAtomPair = "0, 10" and printTaggedPairDistance = "true" in the md file. Then, the distance between integrableObjects 0 and 10 will be computed and printed in the stat file on each statWrite. |
types/ | 3463 (15 years ago) by chuckv: Returned old LD forces to SMIPDForceManager. |
primitives/ | 3466 (15 years ago) by gezelter: many changes to keep track of particle potentials for both bonded and non-bonded interactions |
UseTheForce/ | 3470 (15 years ago) by gezelter: General bug-fixes and other changes to make particle pots work with the Helfand Energy correlation function |
utils/ | 3478 (15 years ago) by gezelter: added viscoConvert |
applications/ | 3479 (15 years ago) by gezelter: use the viscoConvert in OOPSEConstant |
hydrodynamics/ | 3479 (15 years ago) by gezelter: use the viscoConvert in OOPSEConstant |
integrators/ | 3482 (15 years ago) by chuckv: Different method again for Langevin Dynamics. |
math/ | 3482 (15 years ago) by chuckv: Different method again for Langevin Dynamics. |
io/ | 3486 (15 years ago) by gezelter: Added keywords for RNEMD |
brains/ | 3487 (15 years ago) by gezelter: adding support for RNEMD |
config.h.in | 3343 (16 years ago) by gezelter: fixing configure process |