File
|
Last Change |
|---|---|
 ../
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UseTheForce/
|
3470 (16 years ago) by gezelter: General bug-fixes and other changes to make particle pots work with the Helfand Energy correlation function |
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antlr/
|
2970 (18 years ago) by gezelter: starting change of file formats |
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applications/
|
3479 (16 years ago) by gezelter: use the viscoConvert in OOPSEConstant |
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brains/
|
3487 (16 years ago) by gezelter: adding support for RNEMD |
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constraints/
|
3342 (17 years ago) by gezelter: updating configure process |
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hydrodynamics/
|
3479 (16 years ago) by gezelter: use the viscoConvert in OOPSEConstant |
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integrators/
|
3482 (16 years ago) by chuckv: Different method again for Langevin Dynamics. |
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io/
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3486 (16 years ago) by gezelter: Added keywords for RNEMD |
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lattice/
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3446 (16 years ago) by cli2: Inversion fixes and amber mostly working |
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math/
|
3482 (16 years ago) by chuckv: Different method again for Langevin Dynamics. |
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mdParser/
|
3432 (17 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. |
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minimizers/
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3432 (17 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. |
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primitives/
|
3466 (16 years ago) by gezelter: many changes to keep track of particle potentials for both bonded and non-bonded interactions |
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profiling/
|
3342 (17 years ago) by gezelter: updating configure process |
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restraints/
|
3342 (17 years ago) by gezelter: updating configure process |
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selection/
|
2759 (19 years ago) by tim: Adding single precision capabilities to c++ side |
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types/
|
3463 (16 years ago) by chuckv: Returned old LD forces to SMIPDForceManager. |
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utils/
|
3478 (16 years ago) by gezelter: added viscoConvert |
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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. |
config.h.in
|
3343 (17 years ago) by gezelter: fixing configure process |