BiophysicsbioRxivPreprint
Multi-Chain Hamiltonian Replica Exchange Framework for Probing Transient Helices and Order-Disorder Transitions in Proteins
Tika Ram Bhandari, Kurt Kremer, Martin Girard
This paper introduces a multi-chain Hamiltonian replica exchange framework to improve sampling of protein conformations, demonstrating its effectiveness in analyzing transient helices and order-disorder transitions in the IM30 protein.
DOI 10.64898/2026.10.01.755728