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The importance of protonation and tautomerization in relative binding affinity prediction: a comparison of AMBER TI and Schrödinger FEP

Crossref DOI link: https://doi.org/10.1007/s10822-016-9920-5

Published Online: 2016-08-01

Published Print: 2016-07

Update policy: https://doi.org/10.1007/springer_crossmark_policy

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