Christopher Lockhart

9PUBLICATIONS
13CO-AUTHORS
Atomic and molecular physicsPhysical properties of materialsComputational methods in fluid flow, heat and mass transfer (incl. computational fluid dynamics)Statistical mechanics in chemistryMolecular targets
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Publications (9)

|Aug 31, 2026
Replica Exchange Molecular Dynamics with Hydrogen Mass Repartitioning Improves Sampling of Peptide Binding to a Lipid Bilayer.

|Apr 17, 2026
Discovery of actinators, actin-derived bioactive peptides that modulate cytoskeleton and actin-related cellular activities.

|Jan 09, 2026
Accelerating Replica Exchange Molecular Dynamics: A Comparison of Hydrogen Mass Repartitioning and Light Water Models.

Steven R Bowers, William Jeffries, Christopher Lockhart

|Oct 22, 2025
Free Energy Perturbation Simulations Measure the Change in Binding Affinity of the Aβ25-35 Peptide to the Zwitterionic Bilayer Caused by Oxidation.

Xingyu Luo, Elias Khayat, Steven R Bowers

|Sep 13, 2025
Combining Molecular Dynamics and Machine Learning to Predict Drug Resistance Causing Variants of BRAF in Colorectal Cancer.

Longsheng Xie, Christopher Lockhart, Dmitri K Klimov

|Aug 21, 2025
Binding of Antimicrobial Peptide Indolicidin to DMPC Bilayer Using Replica-Exchange Molecular Dynamics.

Alex R Fitz, Dmitri K Klimov, Christopher Lockhart

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Frequent Collaborators

7 joint publications

Dmitri K Klimov

2 joint publications

Kenneth W Foreman

1 joint publications

Kyung Hyeon Lee

1 joint publications

Mohsin Saleet Jafri