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"Molecular dynamics and free energy perturbation study of hydride-ion ..."

Peter L. Cummins, Jill E. Gready (1998)

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DOI: 10.1002/(SICI)1096-987X(199806)19:8<977::AID-JCC15>3.0.CO;2-4

access: closed

type: Journal Article

metadata version: 2020-04-01

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Peter L. Cummins, Jill E. Gready:
Molecular dynamics and free energy perturbation study of hydride-ion transfer step in dihydrofolate reductase using combined quantum and molecular mechanical model. J. Comput. Chem. 19(8): 977-988 (1998)

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