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Showing results 1 to 4 of 4

1
Condensed phase molecular dynamics using interpolated potential energy surfaces with application to the resolvation process of coumarin 153

Park, Jae Woo; Kim, Hyun Woo; Song, Chang-ik; Rhee, Young Min, JOURNAL OF CHEMICAL PHYSICS, v.135, no.1, 2011-07

2
Diabatic Population Matrix Formalism for Performing Molecular Mechanics Style Simulations with Multiple Electronic States

Park, Jae Woo; Rhee, Young Min, JOURNAL OF CHEMICAL THEORY AND COMPUTATION, v.10, no.12, pp.5238 - 5253, 2014-12

3
Modeling Charge Flux by Interpolating Atomic Partial Charges

Kim, Seung Soo; Rhee, Young Min, JOURNAL OF CHEMICAL INFORMATION AND MODELING, v.59, no.6, pp.2837 - 2849, 2019-06

4
Simple Method for Simulating the Mixture of Atomistic and Coarse-Grained Molecular Systems

Sokkar, Pandian; Choi, Sun Mi; Rhee, Young Min, JOURNAL OF CHEMICAL THEORY AND COMPUTATION, v.9, no.8, pp.3728 - 3739, 2013-08

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