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Journal of Chemical Theory and Computation|November 26, 2015
MMPBSA.py: An Efficient Program for End-State Free Energy CalculationsBill R Miller, T Dwight McGee, Jason M Swails, et al.
Journal of Chemical Information and Modeling|November 8, 2021
Substrate Access Mechanism in a Novel Membrane-Bound Phospholipase A of Pseudomonas aeruginosa Concordant with Specificity and RegioselectivitySabahuddin Ahmad, Christoph Heinrich Strunk, Stephan N Schott-Verdugo, et al.
Journal of Chemical Information and Modeling|September 27, 2013
Binding region of alanopine dehydrogenase predicted by unbiased molecular dynamics simulations of ligand diffusionHolger Gohlke, Ulrike Hergert, Tatu Meyer, et al.
Structure (London, England : 1993)|June 9, 2021
Evidence for a credit-card-swipe mechanism in the human PC floppase ABCB4Martin Prescher, Michele Bonus, Jan Stindt, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)|September 10, 2019
Basal Histamine H4 Receptor Activation: Agonist Mimicry by the Diphenylalanine MotifDavid Wifling, Christopher Pfleger, Jonas Kaindl, et al.
Bioorganic & Medicinal Chemistry|August 25, 2019
The tetrahydroxanthone-dimer phomoxanthone A is a strong inducer of apoptosis in cisplatin-resistant solid cancer cellsChenyin Wang, Laura Engelke, David Bickel, et al.
Microbial Cell Factories|September 27, 2017
Contribution of single amino acid and codon substitutions to the production and secretion of a lipase by Bacillus subtilisPia Skoczinski, Kristina Volkenborn, Alexander Fulton, et al.
Biological Chemistry|February 5, 2021
Targeting spectrin redox switches to regulate the mechanoproperties of red blood cellsFrederik Barbarino, Lucas Wäschenbach, Virginia Cavalho-Lemos, et al.
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