Diksha Dewan

Publications

Comparison of Protein-Glycosaminoglycan Interactions in ff14sb/GLYCAM06j-1 and CHARMM36m Force Fields.

KK Bojarski, PA Wesołowski, D Dewan, ŁJ Dziadek, V Neuman, BR Brooks, J Czub, M Zacharias, AK Sieradzan, DJ Wales

J Chem Inf Model

(2026)

acs.jcim.5c03159

Energy Landscape Analysis of Membrane Proteins Using NMR-Based Hybrid Restraint Potentials.

D Dewan, Y Wang, A De Simone, DJ Wales

J Chem Theory Comput

(2026)

acs.jctc.5c02070

Visualizing the energy landscape for a molecular dynamics trajectory

V Neuman, PA Wesołowski, KK Bojarski, D Dewan, M Schäffler, P Smardz, DJ Wales

The Journal of Chemical Physics

(2026)

164

044112

Visualising the Energy Landscape for a Molecular Dynamics Trajectory

V Neuman, P Wesołowski, K Bojarski, D Dewan, M Schäffler, P Smardz, D Wales

(2025)