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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

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Description scientific article published on 15 January 2018
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author: Dávid Bajusz  György G Ferenczy  Gyorgy M Keseru  Bence Szilágyi  Zoltán Orgován 

Publication date January 15, 2018
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