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ReactionMechanismGenerator / RMG-database Public

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Training reactions and polycyclic thermo scripts#93

Merged

connie merged 4 commits intomasterReactionMechanismGenerator/RMG-database:masterfrom addTrainingReactionMechanismGenerator/RMG-database:addTrainingCopy head branch name to clipboard

Feb 29, 2016

+1,092

Conversation Commits4 (4)Checks Files changed

Commits

Commits on Feb 29, 2016

Add .ipynb_checkpoints to .gitignore
connie
committed
fitPolycyclicThermoGroupsFromThermoLibrary script added
connie
committed
Add convertKineticsLibraryToTrainingReactions script
connie
committed
created an ipynb showing the effectiveness of kinetics improvement

KEHANG
authored and
connie
committed

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