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Journal of Chemical Theory and Computation|November 26, 2015
Molecular Dynamics Simulations Predict a Favorable and Unique Mode of Interaction between Lithium (Li(+)) Ions and Hydrophobic Molecules in Aqueous SolutionAndrew S Thomas, Adrian H ElcockThe Journal of Physical Chemistry Letters|August 22, 2015
Direct Measurement of the Kinetics and Thermodynamics of Association of Hydrophobic Molecules from Molecular Dynamics SimulationsAndrew S Thomas, Adrian H ElcockBiorxiv : the Preprint Server for Biology|May 10, 2023
An Orientationally Averaged Version of the Rotne-Prager-Yamakawa Tensor Provides A Fast But Still Accurate Treatment Of Hydrodynamic Interactions In Brownian Dynamics Simulations Of Biological MacromoleculesJohn W Tworek, Adrian H ElcockJournal of Molecular Biology|December 8, 2023
Improving Signal and Transit Peptide Predictions Using AlphaFold2-predicted Protein StructuresVenkata R Sanaboyana, Adrian H ElcockNucleic Acids Research|June 25, 2017
Features of genomic organization in a nucleotide-resolution molecular model of the Escherichia coli chromosomeWilliam C Hacker, Shuxiang Li, Adrian H ElcockJournal of Chemical Theory and Computation|August 6, 2013
Accurate calculation of mutational effects on the thermodynamics of inhibitor binding to p38α MAP kinase: a combined computational and experimental studyShun Zhu, Sue M Travis, Adrian H ElcockBiophysical Journal|August 13, 2013
Flexibility of the bacterial chaperone trigger factor in microsecond-timescale molecular dynamics simulationsAndrew S Thomas, Suifang Mao, Adrian H ElcockJournal of Molecular Biology|November 28, 2021
Identification of Iron-Sulfur (Fe-S) Cluster and Zinc (Zn) Binding Sites Within Proteomes Predicted by DeepMind's AlphaFold2 Program Dramatically Expands the MetalloproteomeZachary J Wehrspan, Robert T McDonnell, Adrian H ElcockNucleic Acids Research|February 1, 2018
The C-terminal region of translesion synthesis DNA polymerase η is partially unstructured and has high conformational flexibilityKyle T Powers, Adrian H Elcock, M Todd WashingtonThe Journal of Physical Chemistry. B|April 8, 2016
Osmotic Pressure Simulations of Amino Acids and Peptides Highlight Potential Routes to Protein Force Field ParameterizationMark S Miller, Wesley K Lay, Adrian H ElcockPageof 7