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* |
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* Created by Charles F. Vardeman II on 11/14/05. |
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* @author Charles F. Vardeman II |
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< |
* @version $Id: SCAtomTypesSectionParser.cpp,v 1.3 2005-12-08 15:38:49 chuckv Exp $ |
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> |
* @version $Id: SCAtomTypesSectionParser.cpp,v 1.4 2006-01-09 19:26:27 chuckv Exp $ |
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* |
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*/ |
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82 |
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scParam.n = tokenizer.nextTokenAsDouble(); |
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scParam.alpha = tokenizer.nextTokenAsDouble(); |
84 |
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85 |
< |
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85 |
> |
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86 |
> |
scParam.epsilon *= options_.getEnergyUnitScaling(); |
87 |
> |
scParam.alpha *= options_.getDistanceUnitScaling(); |
88 |
> |
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89 |
> |
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atomType->addProperty(new SCParamGenericData("SC", scParam)); |
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atomType->setSC(); |
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}else { |