 ../
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AtomStamp.cpp
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883
(19 years ago)
by tim:
adding transpose into SquareMatrix3; fix a bug in AtomStamp where orientation is not set correctly.
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AtomStamp.hpp
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844
(19 years ago)
by gezelter:
Fixed a spelling error
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AtomType.cpp
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728
(19 years ago)
by chuckv:
Sutton-Chen almost done. Just need to fix do_forces to use Sutton-Chen.
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AtomType.hpp
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728
(19 years ago)
by chuckv:
Sutton-Chen almost done. Just need to fix do_forces to use Sutton-Chen.
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AtomTypeProperties.h
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728
(19 years ago)
by chuckv:
Sutton-Chen almost done. Just need to fix do_forces to use Sutton-Chen.
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BendStamp.cpp
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770
(19 years ago)
by tim:
End of the Link --> List
Return of the Oject-Oriented
replace yacc/lex parser with antlr parser
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BendStamp.hpp
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846
(19 years ago)
by tim:
fix some error messages
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BendType.hpp
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507
(20 years ago)
by gezelter:
xemacs has been drafted to perform our indentation services
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BondStamp.cpp
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770
(19 years ago)
by tim:
End of the Link --> List
Return of the Oject-Oriented
replace yacc/lex parser with antlr parser
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BondStamp.hpp
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846
(19 years ago)
by tim:
fix some error messages
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BondType.hpp
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507
(20 years ago)
by gezelter:
xemacs has been drafted to perform our indentation services
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CharmmTorsionType.cpp
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749
(19 years ago)
by tim:
OptionSectionParser get compiled
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CharmmTorsionType.hpp
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749
(19 years ago)
by tim:
OptionSectionParser get compiled
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Component.cpp
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770
(19 years ago)
by tim:
End of the Link --> List
Return of the Oject-Oriented
replace yacc/lex parser with antlr parser
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Component.hpp
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770
(19 years ago)
by tim:
End of the Link --> List
Return of the Oject-Oriented
replace yacc/lex parser with antlr parser
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CubicBendType.hpp
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507
(20 years ago)
by gezelter:
xemacs has been drafted to perform our indentation services
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CubicBondType.hpp
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507
(20 years ago)
by gezelter:
xemacs has been drafted to perform our indentation services
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CubicTorsionType.hpp
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749
(19 years ago)
by tim:
OptionSectionParser get compiled
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CutoffGroupStamp.cpp
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770
(19 years ago)
by tim:
End of the Link --> List
Return of the Oject-Oriented
replace yacc/lex parser with antlr parser
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CutoffGroupStamp.hpp
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770
(19 years ago)
by tim:
End of the Link --> List
Return of the Oject-Oriented
replace yacc/lex parser with antlr parser
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DataHolder.hpp
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845
(19 years ago)
by tim:
instead of printing to std::cout, throwing an exception when error is found.
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DirectionalAtomType.cpp
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676
(20 years ago)
by gezelter:
changing GB architecture
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DirectionalAtomType.hpp
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676
(20 years ago)
by gezelter:
changing GB architecture
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FixedBondType.hpp
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507
(20 years ago)
by gezelter:
xemacs has been drafted to perform our indentation services
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FragmentStamp.cpp
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779
(19 years ago)
by tim:
Adding FragmentStamp
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FragmentStamp.hpp
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779
(19 years ago)
by tim:
Adding FragmentStamp
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HarmonicBendType.hpp
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507
(20 years ago)
by gezelter:
xemacs has been drafted to perform our indentation services
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HarmonicBondType.hpp
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507
(20 years ago)
by gezelter:
xemacs has been drafted to perform our indentation services
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Makefile
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770
(19 years ago)
by tim:
End of the Link --> List
Return of the Oject-Oriented
replace yacc/lex parser with antlr parser
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MoleculeStamp.cpp
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845
(19 years ago)
by tim:
instead of printing to std::cout, throwing an exception when error is found.
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MoleculeStamp.hpp
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784
(19 years ago)
by tim:
adding more checking for topology
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MorseBondType.hpp
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507
(20 years ago)
by gezelter:
xemacs has been drafted to perform our indentation services
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OplsTorsionType.hpp
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507
(20 years ago)
by gezelter:
xemacs has been drafted to perform our indentation services
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PolynomialBendType.hpp
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507
(20 years ago)
by gezelter:
xemacs has been drafted to perform our indentation services
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PolynomialBondType.hpp
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507
(20 years ago)
by gezelter:
xemacs has been drafted to perform our indentation services
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PolynomialTorsionType.hpp
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749
(19 years ago)
by tim:
OptionSectionParser get compiled
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QuarticBendType.hpp
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507
(20 years ago)
by gezelter:
xemacs has been drafted to perform our indentation services
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QuarticBondType.hpp
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507
(20 years ago)
by gezelter:
xemacs has been drafted to perform our indentation services
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QuarticTorsionType.hpp
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749
(19 years ago)
by tim:
OptionSectionParser get compiled
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RigidBodyStamp.cpp
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770
(19 years ago)
by tim:
End of the Link --> List
Return of the Oject-Oriented
replace yacc/lex parser with antlr parser
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RigidBodyStamp.hpp
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770
(19 years ago)
by tim:
End of the Link --> List
Return of the Oject-Oriented
replace yacc/lex parser with antlr parser
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ShapeAtomType.cpp
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517
(20 years ago)
by chrisfen:
Got rid of write statements and am closer to a working shapes
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ShapeAtomType.hpp
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514
(20 years ago)
by chrisfen:
Shapes is limping along with a array bounds overwrite (I think...). At least the parser loads the forcefield fine...
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TorsionStamp.cpp
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770
(19 years ago)
by tim:
End of the Link --> List
Return of the Oject-Oriented
replace yacc/lex parser with antlr parser
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TorsionStamp.hpp
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846
(19 years ago)
by tim:
fix some error messages
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TorsionType.hpp
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749
(19 years ago)
by tim:
OptionSectionParser get compiled
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UreyBradleyBendType.hpp
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507
(20 years ago)
by gezelter:
xemacs has been drafted to perform our indentation services
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ZconsStamp.cpp
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770
(19 years ago)
by tim:
End of the Link --> List
Return of the Oject-Oriented
replace yacc/lex parser with antlr parser
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ZconsStamp.hpp
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770
(19 years ago)
by tim:
End of the Link --> List
Return of the Oject-Oriented
replace yacc/lex parser with antlr parser
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