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Ernest Awoonor-Williams

Showing results (1-10 of 18) with videos related to

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Physical Chemistry Chemical Physics : PCCP|September 21, 2022
Estimating the binding energetics of reversible covalent inhibitors of the SARS-CoV-2 main protease: an <i>in silico</i> studyErnest Awoonor-Williams
Journal of Chemical Theory and Computation|August 20, 2016
Evaluation of Methods for the Calculation of the pKa of Cysteine Residues in ProteinsErnest Awoonor-Williams, Christopher N Rowley
The Journal of Chemical Physics|August 3, 2018
The hydration structure of methylthiolate from QM/MM molecular dynamicsErnest Awoonor-Williams, Christopher N Rowley
Journal of Chemical Information and Modeling|August 18, 2018
How Reactive are Druggable Cysteines in Protein Kinases?Ernest Awoonor-Williams, Christopher N Rowley
Biochimica Et Biophysica Acta|December 27, 2015
Molecular simulation of nonfacilitated membrane permeationErnest Awoonor-Williams, Christopher N Rowley
Journal of Chemical Information and Modeling|September 30, 2021
Modeling the Binding and Conformational Energetics of a Targeted Covalent Inhibitor to Bruton's Tyrosine KinaseErnest Awoonor-Williams, Christopher N Rowley
The Journal of Chemical Physics|January 23, 2017
The hydration structure of carbon monoxide by ab initio methodsErnest Awoonor-Williams, Christopher N Rowley
Journal of Chemical Theory and Computation|September 28, 2016
Generalized Langevin Methods for Calculating Transmembrane DiffusivityKari Gaalswyk, Ernest Awoonor-Williams, Christopher N Rowley
Journal of Chemical Information and Modeling|March 30, 2023
Benchmarking <i>In Silico</i> Tools for Cysteine p<i>K</i><sub>a</sub> PredictionErnest Awoonor-Williams, Andrei A Golosov, Viktor Hornak
Biochimica Et Biophysica Acta. Proteins and Proteomics|May 23, 2017
Modeling covalent-modifier drugsErnest Awoonor-Williams, Andrew G Walsh, Christopher N Rowley
Pageof 2

Showing results (1-10 of 18) with videos related to

Sort By:
Pageof 2
Physical Chemistry Chemical Physics : PCCP|September 21, 2022
Estimating the binding energetics of reversible covalent inhibitors of the SARS-CoV-2 main protease: an <i>in silico</i> studyErnest Awoonor-Williams
Journal of Chemical Theory and Computation|August 20, 2016
Evaluation of Methods for the Calculation of the pKa of Cysteine Residues in ProteinsErnest Awoonor-Williams, Christopher N Rowley
The Journal of Chemical Physics|August 3, 2018
The hydration structure of methylthiolate from QM/MM molecular dynamicsErnest Awoonor-Williams, Christopher N Rowley
Journal of Chemical Information and Modeling|August 18, 2018
How Reactive are Druggable Cysteines in Protein Kinases?Ernest Awoonor-Williams, Christopher N Rowley
Biochimica Et Biophysica Acta|December 27, 2015
Molecular simulation of nonfacilitated membrane permeationErnest Awoonor-Williams, Christopher N Rowley
Journal of Chemical Information and Modeling|September 30, 2021
Modeling the Binding and Conformational Energetics of a Targeted Covalent Inhibitor to Bruton's Tyrosine KinaseErnest Awoonor-Williams, Christopher N Rowley
The Journal of Chemical Physics|January 23, 2017
The hydration structure of carbon monoxide by ab initio methodsErnest Awoonor-Williams, Christopher N Rowley
Journal of Chemical Theory and Computation|September 28, 2016
Generalized Langevin Methods for Calculating Transmembrane DiffusivityKari Gaalswyk, Ernest Awoonor-Williams, Christopher N Rowley
Journal of Chemical Information and Modeling|March 30, 2023
Benchmarking <i>In Silico</i> Tools for Cysteine p<i>K</i><sub>a</sub> PredictionErnest Awoonor-Williams, Andrei A Golosov, Viktor Hornak
Biochimica Et Biophysica Acta. Proteins and Proteomics|May 23, 2017
Modeling covalent-modifier drugsErnest Awoonor-Williams, Andrew G Walsh, Christopher N Rowley
Pageof 2