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trunk/
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2097 (20 years ago) by tim: adding IndexFinder which is used to select the molecules; Seperate ElectrostaticAtomTypesSectionParser into ChargeAtomTypesSectionParser and MultipoleAtomTypesSectionParser;remove print dipole option from Dump2XYZ; |
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tags/
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1491 (21 years ago) by : This commit was manufactured by cvs2svn to create tag 'OOPSE_REWRITE'. |
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branches/
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1929 (20 years ago) by tim: forget to include <algorithm> |