Showing results 1 to 3 of 3
Exploring the Possibility of Excited State Keto-Enolate Transformation of the Oxyluciferin-Luciferase Complex with QM/MM Free Energy Simulations Chung, Seyoung; Choi, Sun Mi; Rhee, Young Min, CHEMPHOTOCHEM, v.3, no.9, pp.804 - 813, 2019-09 |
Free energy level correction by Monte Carlo resampling with weighted histogram analysis method(dagger) Chung, Seyoung; Choi, Sun Mi; Lee, Wook; Cho, Kwang Hyun; Rhee, Young Min, CHINESE JOURNAL OF CHEMICAL PHYSICS, v.33, no.2, pp.183 - 195, 2020-04 |
Interpolation for molecular dynamics simulations: from ions in gas phase to proteins in solution Rhee, Young Min; Park, Jae Woo, INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, v.116, no.8, pp.573 - 577, 2016-04 |
Discover