The journal of physical chemistry. BMolecular Dynamics SimulationStochastic ProcessesRetinoid X ReceptorsLigandsGene Expression Regulation
From Molecules to Mechanisms: Integrating MD and Stochastic Modeling to Decipher RXR-RAR Gene Regulation.
Naresh Kumar, Dinesh Kashyap, Prabir Khatua, Sudipta Kumar Sinha
Published: 202510.1021/acs.jpcb.5c06320
Abstract
This study integrates atomistic molecular dynamics (MD) simulations with stochastic modeling to unravel the gene regulatory mechanism mediated by nuclear receptors (NRs), ligand-activated transcription factors. We specifically study the heterodimeric…
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