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ReactionMechanismGenerator / RMG-database Public

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Cyclic database improvements#92

Merged

connie merged 9 commits intomasterReactionMechanismGenerator/RMG-database:masterfrom

ipsoDatabaseReactionMechanismGenerator/RMG-database:ipsoDatabaseCopy head branch name to clipboard

Feb 28, 2016

Conversation Commits9 (9)Checks Files changed

Merged

Cyclic database improvements#92
connie merged 9 commits intomasterfrom
ipsoDatabase

Commits

Commits on Feb 28, 2016

Diels_alder_addition: ban the benzyl radical isomers from reacting
connie
committed
Update polycyclic groups in thermo database
connie
committed
Add Aromatic and Benzene groups to ring thermo groups with zero value.
connie
committed
Add ranks to some thermo cyclic groups.
connie
committed
Training reactions from vinylCPD_H library
connie
committed
Training reactions from C3 kinetics library
connie
committed
Training reactions from C10H11 kinetics library
connie
committed
Training reactions from Fulvene_H kinetics library
connie
committed
Training reactions from naphthalene_H kinetics library
connie
committed

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