File
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Last Change |
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 ../
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visitors/
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1291 (17 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. |
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utils/
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1321 (16 years ago) by gezelter: added viscoConvert |
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types/
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1306 (17 years ago) by chuckv: Returned old LD forces to SMIPDForceManager. |
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selection/
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963 (19 years ago) by tim: Adding single precision capabilities to c++ side |
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restraints/
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1225 (17 years ago) by gezelter: updating configure process |
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profiling/
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1225 (17 years ago) by gezelter: updating configure process |
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primitives/
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1309 (17 years ago) by gezelter: many changes to keep track of particle potentials for both bonded and non-bonded interactions |
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minimizers/
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1277 (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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mdParser/
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1277 (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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math/
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1336 (16 years ago) by gezelter: adding jama and tnt libraries for various linear algebra routines |
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lattice/
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1290 (17 years ago) by cli2: Inversion fixes and amber mostly working |
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io/
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1331 (16 years ago) by gezelter: Adding options to RNEMD for selecting particular StuntDoubles |
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integrators/
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1338 (16 years ago) by skuang: Added a getStatus routine to check the temperatures |
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hydrodynamics/
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1322 (16 years ago) by gezelter: use the viscoConvert in OOPSEConstant |
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constraints/
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1225 (17 years ago) by gezelter: updating configure process |
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brains/
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1328 (16 years ago) by gezelter: adding support for RNEMD |
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applications/
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1322 (16 years ago) by gezelter: use the viscoConvert in OOPSEConstant |
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antlr/
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1021 (19 years ago) by gezelter: starting change of file formats |
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UseTheForce/
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1337 (16 years ago) by gezelter: fixed a bug in self interactions |
config.h.in
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1226 (17 years ago) by gezelter: fixing configure process |