Dmitri K. Klimov

Binding of Cytotoxic Aβ25-35 Peptide to the Dimyristoylphosphatidylcholine Lipid Bilayer

Amy K. Smith, Dmitri K. Klimov, D. Klimov, 2018, J. Chem. Inf. Model..

Is the Conformational Ensemble of Alzheimer’s Aβ10-40 Peptide Force Field Dependent?

Dmitri K. Klimov, Christopher M. Siwy, Christopher Lockhart, 2017, PLoS Comput. Biol..

Greedy replica exchange algorithm for heterogeneous computing grids

Dmitri K. Klimov, Christopher Lockhart, Steven Armentrout, 2015, Journal of Molecular Modeling.

Partitioning of Benzoic Acid into 1, 2-Dimyristoyl-sn-glycero-3-phosphocholine and Blood-Brain Barrier Mimetic Bilayers

Amy K. Smith, Dmitri K. Klimov, Christopher M. Siwy, 2020, J. Chem. Inf. Model..

Machine learning-based prediction of drug and ligand binding in BCL-2 variants through molecular dynamics

Matthew McCoy, Dmitri K. Klimov, John R. Hamre, 2021, Comput. Biol. Medicine.

Caging helps proteins fold

Dmitri K. Klimov, D. Thirumalai, D. Thirumalai, 2003, Proceedings of the National Academy of Sciences of the United States of America.

Insights into Specific Problems in Protein Folding Using Simple Concepts

Dmitri K. Klimov, Ruxandra I. Dima, Devarajan Thirumalai, 2002 .

Proteins: Structure, Function, and Bioinformatics

Harold A. Scheraga, Yelena A. Arnautova, Jorge A. Vila, 2009 .

Progressing from folding trajectories to transition state ensemble in proteins

Dmitri K. Klimov, D. Thirumalai, D. Thirumalai, 2004 .