A Comparative Study of Two Different Force Fields on Structural and Thermodynamics Character of H1 Peptide via Molecular Dynamics Simulations

Study of Early Events in the Protein Folding of Villin Headpiece using Molecular Dynamics Simulation

(2012) Uddhavesh B. Sonavane et al.   JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS

Study of Multiple Unfolding Trajectories and Unfolded States of the Protein GB1 Under the Physical Property Space

(2012) Jihua Wang et al.   JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS

Conformational Characteristics of Unstructured Peptides: α-Synuclein

(2012) Jeseong Yoon et al.   JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS

RING Domains Functioning as E3 Ligases Reveal Distinct Structural Features: A Molecular Dynamics Simulation Study

(2012) Jian-Hua Zhao et al.   JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS

Dynamics and Local Ordering of Spin-Labeled Prion Protein: An ESR Simulation Study of a Highly PH-Sensitive Site

(2012) Yun-Wei Chiang et al.   JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS

Molecular Dynamics Simulations to Gain Insights into the Stability and Morphologies of K3 Oligomers from β2-microglobulin

(2012) Po-Sheng Fang et al.   JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS

Molecular Dynamics Simulations to Investigate the Structural Stability and Aggregation Behavior of the GGVVIA Oligomers Derived from Amyloid β Peptide

(2012) Liang-Kai Chang et al.   JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS

Biomolecular simulation: historical picture and future perspectives

(2008) Wilfred F. van Gunsteren et al.   BIOCHEMICAL SOCIETY TRANSACTIONS

Using free energy perturbation to predict effects of changing force field parameters on computed conformational equilibriums of peptides

(2008) Zanxia Cao et al.   JOURNAL OF CHEMICAL PHYSICS

Refining the description of peptide backbone conformations improves protein simulations using the GROMOS 53A6 force field

(2008) Zanxia Cao et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Fragment replica-exchange method for efficient protein conformation sampling

(2008) M. Suzuki et al.   MOLECULAR SIMULATION

A temperature predictor for parallel tempering simulations

(2008) Alexandra Patriksson et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS