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"Validation of tautomeric and protomeric binding modes by free energy ..."

Zoltán Orgován et al. (2018)

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DOI: 10.1007/S10822-018-0097-Y

access: closed

type: Journal Article

metadata version: 2020-04-16

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  - journals/jcamd/OrgovanFSSBK18
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  - https://dblp.org/rec/journals/jcamd/OrgovanFSSBK18
Zoltán Orgován, György G. Ferenczy, Thomas Steinbrecher, Bence Szilágyi, Dávid Bajusz, György M. Keserü:
Validation of tautomeric and protomeric binding modes by free energy calculations. A case study for the structure based optimization of d-amino acid oxidase inhibitors. J. Comput. Aided Mol. Des. 32(2): 331-345 (2018)

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