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/dports/science/cdk/cdk-cdk-2.3/legacy/src/main/java/org/openscience/cdk/tools/
H A DIonizationPotentialTool.java462 IReactionProcess reactionNBE = new ElectronImpactNBEReaction(); in initiateIonization() local
472 reactionNBE.setParameterList(paramList); in initiateIonization()
475 IReactionSet setOfReactions = reactionNBE.initiate(setOfReactants, null); in initiateIonization()