../
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AtomTypesSectionParser.cpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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AtomTypesSectionParser.hpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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BaseAtomTypesSectionParser.cpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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BaseAtomTypesSectionParser.hpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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BendTypesSectionParser.cpp
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1459
(14 years ago)
by gezelter:
Fixed a potentially serious bug in GhostBend and GhostTorsion. We
were using A instead of A.transpose() where we need lab-frame
coordinates of the body-fixed axis.
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BendTypesSectionParser.hpp
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1451
(14 years ago)
by gezelter:
added new CosineBendType
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BondTypesSectionParser.cpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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BondTypesSectionParser.hpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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ChargeAtomTypesSectionParser.cpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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ChargeAtomTypesSectionParser.hpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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DirectionalAtomTypesSectionParser.cpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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DirectionalAtomTypesSectionParser.hpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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DumpReader.cpp
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1450
(14 years ago)
by gezelter:
Added tests to make sure requisite position & orientation information
are present in dump file.
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DumpReader.hpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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DumpWriter.cpp
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1564
(14 years ago)
by chuckv:
Changed dumpwriter to synchronize file writing to avoid file descriptor issuse on large (>1000 nodes).
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DumpWriter.hpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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EAMAtomTypesSectionParser.cpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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EAMAtomTypesSectionParser.hpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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ForceFieldOptions.cpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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ForceFieldOptions.hpp
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1548
(14 years ago)
by gezelter:
Added a check to make sure value matches data type of parameter
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GayBerneAtomTypesSectionParser.cpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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GayBerneAtomTypesSectionParser.hpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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Globals.cpp
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1559
(14 years ago)
by skuang:
added new variables for RNEMD
remove requirement of non-negative targetFlux for RNEMD
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Globals.hpp
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1559
(14 years ago)
by skuang:
added new variables for RNEMD
remove requirement of non-negative targetFlux for RNEMD
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InversionTypesSectionParser.cpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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InversionTypesSectionParser.hpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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LennardJonesAtomTypesSectionParser.cpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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LennardJonesAtomTypesSectionParser.hpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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Makefile
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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MetalNonMetalInteractionsSectionParser.cpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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MetalNonMetalInteractionsSectionParser.hpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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MultipoleAtomTypesSectionParser.cpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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MultipoleAtomTypesSectionParser.hpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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OptionSectionParser.cpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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OptionSectionParser.hpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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ParamConstraint.cpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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ParamConstraint.hpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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RestReader.cpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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RestReader.hpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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RestWriter.cpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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RestWriter.hpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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SCAtomTypesSectionParser.cpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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SCAtomTypesSectionParser.hpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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SectionParser.cpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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SectionParser.hpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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SectionParserManager.cpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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SectionParserManager.hpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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ShapeAtomTypesSectionParser.cpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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ShapeAtomTypesSectionParser.hpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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StatWriter.cpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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StatWriter.hpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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StickyAtomTypesSectionParser.cpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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StickyAtomTypesSectionParser.hpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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StickyPowerAtomTypesSectionParser.cpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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StickyPowerAtomTypesSectionParser.hpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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TorsionTypesSectionParser.cpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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TorsionTypesSectionParser.hpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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ZConsReader.cpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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ZConsReader.hpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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ZConsWriter.cpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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ZConsWriter.hpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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basic_ifstrstream.hpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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basic_teebuf.hpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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gzstream.cpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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gzstream.hpp
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1442
(15 years ago)
by gezelter:
Adding property set to svn entries
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