Reaction barriers of chorismate mutase calculated using ONIOM.
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https://figshare.com/articles/dataset/_Reaction_barriers_of_chorismate_mutase_calculated_using_ONIOM_/681122
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The reaction coordinates in Å for the reactant, transition state and product are RR, RTS and RP, respectively. The barrier height of the transition state ETS−R and the overall reaction energy EP−R are in kcal/mol.
创建时间:
2013-04-12



