Characterizing the protonation states of the catalytic residues in apo and substrate-bound human T-cell leukemia virus type 1 protease

Published 2015 View Full Article

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Title
Characterizing the protonation states of the catalytic residues in apo and substrate-bound human T-cell leukemia virus type 1 protease
Authors
Keywords
HTLV-1 protease, Catalytic residues, Protonation states, Free energy simulations, QM/MM
Journal
COMPUTATIONAL BIOLOGY AND CHEMISTRY
Volume 56, Issue -, Pages 61-70
Publisher
Elsevier BV
Online
2015-04-10
DOI
10.1016/j.compbiolchem.2015.04.002

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