File |
Last Change
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3448 (15 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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3446 (15 years ago) by cli2: Inversion fixes and amber mostly working |
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3446 (15 years ago) by cli2: Inversion fixes and amber mostly working |
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3328 (16 years ago) by xsun: new visitors for some odd molecules |
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3328 (16 years ago) by xsun: new visitors for some odd molecules |
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2954 (18 years ago) by chrisfen: Added TRED water visitor for Dump2XYZ visualization |
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2954 (18 years ago) by chrisfen: Added TRED water visitor for Dump2XYZ visualization |
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2759 (18 years ago) by tim: Adding single precision capabilities to c++ side |
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2759 (18 years ago) by tim: Adding single precision capabilities to c++ side |
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2245 (19 years ago) by tim: adding AtomNameVisitor |
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2245 (19 years ago) by tim: adding AtomNameVisitor |
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2240 (19 years ago) by tim: adding AtomNameVisitor to convert atom name to its base name; wrappingvisitor now wrap back to the center of the mass; adding P2OrderParameter into StaticProps |
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2204 (19 years ago) by gezelter: xemacs has been drafted to perform our indentation services |
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2204 (19 years ago) by gezelter: xemacs has been drafted to perform our indentation services |
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2204 (19 years ago) by gezelter: xemacs has been drafted to perform our indentation services |
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2204 (19 years ago) by gezelter: xemacs has been drafted to perform our indentation services |
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2204 (19 years ago) by gezelter: xemacs has been drafted to perform our indentation services |