Binding of Inhibitors to Nuclear Localization Signal Peptide from Venezuelan Equine Encephalitis Virus Capsid Protein Explored with All-Atom Replica Exchange Molecular Dynamics

• Bryan M. Delfing,
• Xavier E. Laracuente,
• Xingyu Luo,
• Audrey Olson,
• William Jeffries,
• Kenneth W. Foreman,
• Mikell Paige,
• Kylene Kehn-Hall,
• Christopher Lockhart,
• Dmitri K. Klimov

Affiliations

Bryan M. Delfing

School of Systems Biology, George Mason University, Manassas, Virginia, United States

Xavier E. Laracuente

School of Systems Biology, George Mason University, Manassas, Virginia, United States

Xingyu Luo

School of Systems Biology, George Mason University, Manassas, Virginia, United States

Audrey Olson

School of Systems Biology, George Mason University, Manassas, Virginia, United States

William Jeffries

School of Systems Biology, George Mason University, Manassas, Virginia, United States

Kenneth W. Foreman

Department of Chemistry and Biochemistry, George Mason University, Fairfax, Virginia, United States

Mikell Paige

Department of Chemistry and Biochemistry, George Mason University, Fairfax, Virginia, United States

Kylene Kehn-Hall

Department of Biomedical Sciences and Pathobiology, Virginia-Maryland College of Veterinary Medicine, Virginia Polytechnic Institute and State University, Blacksburg, Virginia, United States

Christopher Lockhart

School of Systems Biology, George Mason University, Manassas, Virginia, United States

Dmitri K. Klimov

School of Systems Biology, George Mason University, Manassas, Virginia, United States