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2051 (10 years ago) by gezelter: Fixed a frequency computation bug in a utility script |
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1977 (11 years ago) by gezelter: Removed some scary errors that are really supposed to be OPENMD_INFO messages |
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2052 (10 years ago) by gezelter: Updating Hydrogen Bonding structures, and selection syntax to include molecule selections: |
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1978 (11 years ago) by gezelter: More error message clarifications, added a few steps to the builders sample |
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2046 (10 years ago) by gezelter: Fixed some broken comments for use with Doxygen. Made changes to allow topology-based force-field overrides in include files. Fixed a calculation of box quadrupole moments for molecules with point dipoles. |
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1879 (12 years ago) by gezelter: MERGE OpenMD development 1783:1878 into trunk |
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1978 (11 years ago) by gezelter: More error message clarifications, added a few steps to the builders sample |
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1985 (11 years ago) by gezelter: Dates updated |
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1977 (11 years ago) by gezelter: Removed some scary errors that are really supposed to be OPENMD_INFO messages |
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1985 (11 years ago) by gezelter: Dates updated |
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2056 (10 years ago) by gezelter: Fixes to HullFinder (and by extension to RNEMD) for getSurfaceArea() call. Adding Multipass Correlation Function (unused right now). |
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1879 (12 years ago) by gezelter: MERGE OpenMD development 1783:1878 into trunk |
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1891 (12 years ago) by gezelter: Fixed a URL |