Mapping Structural Drivers of Insulin Analogs Using Molecular Dynamics and Free Energy Calculations at Insulin Receptor
A. Ranganathan, M. M. M. Sena, R. Chandrasekaran, M. Chatterji, A. Khedkar, M. Gromiha
This study uses molecular dynamics and free energy calculations to analyze insulin-IR interactions and identify potency determinants in natural and synthetic insulin analogs.
bioRxiv · May 27, 2022 · PreprintBiophysics