Researcher
Josh Vermaas
Oak Ridge National Laboratory
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24 papers found
Papers authored by Josh Vermaas
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Diane L. Lynch,
Isabella Daidone ,
Laura Zanetti-Polzi ,
Micholas Dean Smith,
Chris Chipot,
Daniel W. Kneller ,
Andrey Kovalevsky ,
Leighton Coates ,
Andrei A. Golosov,
Callum J. Dickson,
Jeremy C. Smith,
Camilo Velez-Vega,
Jose S. Duca ,
Josh V. Vermaas
and 5 other authors
Inhibitor binding influences the protonation states of histidines in SARS-CoV-2 main protease
Download from pubs.rsc.org
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Rupesh Agarwal ,
Matthew B. Baker,
Jerome Baudry ,
Debsindhu Bhowmik ,
Swen Boehm,
Kendall G. Byler,
Sam Yen-Chi Chen,
Leighton Coates ,
Connor J. Cooper ,
Omar Demerdash,
Isabella Daidone ,
John D. Eblen,
Sally R. Ellingson,
Stefano Forli
and 37 other authors
Supercomputer-Based Ensemble Docking Drug Discovery Pipeline with Application to Covid-19
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Susan B. Rempe,
Susan L. Rempe,
Emad Tajkhorshid
Electrostatic lock in the transport cycle of the multidrug resistance transporter EmrE
Download from www.pnas.org
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Loukas Petridis ,
John Ralph ,
Gregg T. Beckham ,
Michael F. Crowley
Systematic Parameterization of Lignin for the Charmm Force Field
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Emad Tajkhorshid
Differential Membrane Binding Mechanics of Synaptotagmin Isoforms Observed in Atomic Detail
Download from www.ncbi.nlm.nih.gov
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David J. Hardy,
John E. Stone,
Emad Tajkhorshid,
Axel Kohlmeyer
TopoGromacs: Automated Topology Conversion from CHARMM to GROMACS within VMD
Download from www.ncbi.nlm.nih.gov
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Melanie P. Muller,
Mark J. Arcario,
Taras V. Pogorelov,
Emad Tajkhorshid
Atomic–Level Description of Protein–Lipid Interactions Using an Accelerated Membrane Model
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Loukas Petridis ,
Xianghong Qi,
Roland Schulz,
Benjamin Lindner,
Jeremy C. Smith
Mechanism of lignin inhibition of enzymatic biomass deconstruction
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Taras V. Pogorelov,
Emad Tajkhorshid,
Soohyung Park ,
Jeffery B. Klauda,
Wonpil Im
CHARMM-GUI HMMM Builder for Membrane Simulations with the Highly Mobile Membrane-Mimetic Model
Download from europepmc.org
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Javier L. Baylon,
Mark J. Arcario,
Melanie P. Muller,
Zhe Wu,
Taras V. Pogorelov,
Emad Tajkhorshid
Efficient Exploration of Membrane-Associated Phenomena at Atomic Resolution
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Alexander T. Taguchi,
Sergei A. Dikanov,
Colin A. Wraight,
Emad Tajkhorshid
Download from www.ncbi.nlm.nih.gov
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Emad Tajkhorshid
Conformational heterogeneity of α-synuclein in membrane
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