Tiefeng Song

This study uses molecular dynamics simulations and electrophysiology to analyze the conformational changes in AaegOR10, showing how ligand binding affects pore opening.

This study investigates the ligand binding kinetics, thermodynamics, and gating of the insect odorant receptor MhOR5 using molecular dynamics simulations, revealing key structural determinants and differences in ligand behavior.

The paper introduces pHaseMD4AI, a molecular dynamics dataset with chemical and pH perturbations, to support biomolecular AI research and benchmarking.