Three faculty and one graduate student co-authored a paper titled “Statistical Coupling Analysis combined with all-atom Molecular Simulation Postulates Dynamical Allosterism in the MutS DNA Mismatch Repair Protein,” published in the March issue of the Journal of Physical Chemistry – Biophysics, published by The American Chemical Society.
The authors include David Beveridge, the Joshua Boger University Professor of the Sciences and Mathematics, professor of chemistry, professor of integrative sciences; Manju Hingorani, professor of molecular biology and biochemistry, professor of integrative sciences; Kelly Thayer, visiting assistant professor of computer science; and molecular biology and biochemistry graduate student Bharat Lakhani.
This project is part of Lakhani’s ’16 PhD thesis of Lakhani. Notably, the project brings together the experimental biochemistry of Hingorani’s research program, which specializes in DNA mismatch repair, and the computational biophysics in Beveridge’s Laboratory, which specializes in molecular dynamics simulations. All theoretical calculations were carried out using the Wesleyan High Performance Computer Cluster.
In addition, the article was selected as an ACS “Editor’s Choice,” an honor given to one article from the entire ACS portfolio of journals each day of the year. As a consequence, the authors have been invited to submit a 30-40 minute online presentation to “ACS LiveSlides,” which increases the exposure of the published work.