Direct folding studies of various α and β strands using replica exchange molecular dynamics simulation

All-atom level direct folding simulation of a ββα mini-protein

Consistent free energy landscapes and thermodynamic properties of small proteins based on a single all-atom force field employing an implicit solvation

Folding simulations with novel conformational search method

Direct Folding Simulation of α-helices and β-hairpins based on a Single All-atom Force Field with an Implicit Solvation Model.

Free energy surfaces of miniproteins with a beta-beta-alpha motif: Replica exchange molecular dynamics simulation with an implicit solvation modell

Relationship between the Ratio of Ligand to Metal and the Coordinating Ability of Anions. Synthesis and Structural Properties of AgX-Bearing Bis(4-pyridyl)dimethylsilane (X- ) NO2

Misfolded free energy surface of a peptide with αββ motif(1PSV) by using the generalized Born solvation model

Replica-Exchange Method Using the Generalized Effective Potential

Ab initio Folding of Helix Bundle Proteins using Molecular Dynamics Simulation