Area of research
Materials Chemistry · Condensed Matter Physics
Research interest
Research interests include Material Dynamics and Properties, Theoretical and Computational Physics, Block Copolymer Self-Assembly, and Protein Structure and Dynamics.
OpenMSCG: A Software Tool for Bottom-Up Coarse-Graining
Bottom-up Coarse-Graining: Principles and Perspectives
Understanding dynamics in coarse-grained models. I. Universal excess entropy scaling relationship
Understanding dynamics in coarse-grained models. II. Coarse-grained diffusion modeled using hard sphere theory
Constructing many-body dissipative particle dynamics models of fluids from bottom-up coarse-graining
A new one-site coarse-grained model for water: Bottom-up many-body projected water (BUMPer). I. General theory and model
A new one-site coarse-grained model for water: Bottom-up many-body projected water (BUMPer). II. Temperature transferability and structural properties at low temperature
Temperature and Phase Transferable Bottom-up Coarse-Grained Models
Atomic-scale characterization of mature HIV-1 capsid stabilization by inositol hexakisphosphate (IP <sub>6</sub> )
Understanding Missing Entropy in Coarse-Grained Systems: Addressing Issues of Representability and Transferability
Coarse-Grained Simulation of Full-Length Integrin Activation
Coarse-graining involving virtual sites: Centers of symmetry coarse-graining
Ultra-Coarse-Grained Models Allow for an Accurate and Transferable Treatment of Interfacial Systems
Ultra-Coarse-Grained Liquid State Models with Implicit Hydrogen Bonding
The Theory of Ultra-Coarse-Graining. 3. Coarse-Grained Sites with Rapid Local Equilibrium of Internal States
Extending the range and physical accuracy of coarse-grained models: Order parameter dependent interactions