Non-Markov-Type Analysis and Diffusion Map Analysis for Molecular Dynamics Trajectory of Chignolin at a High Temperature.
- Published in:
- Life (2075-1729), 2022, v. 12, n. 8, p. 1188, doi. 10.3390/life12081188
- By:
- Publication type:
- Article
Works by Mitsutake, Ayori
Results: 8
1
2
A pH-dependent variation in α-helix structure of the S-peptide of ribonuclease A studied by Monte Carlo simulated annealing.
- Published in:
- Biopolymers, 2002, v. 63, n. 4, p. 273, doi. 10.1002/bip.10055
- By:
- Publication type:
- Article
3
Generalized-ensemble algorithms for molecular simulations of biopolymers.
- Published in:
- Biopolymers, 2001, v. 60, n. 2, p. 96, doi. 10.1002/1097-0282(2001)60:2<96::AID-BIP1007>3.0.CO;2-F
- By:
- Publication type:
- Article
4
Application of reference-modified density functional theory: Temperature and pressure dependences of solvation free energy.
- Published in:
- Journal of Computational Chemistry, 2018, v. 39, n. 4, p. 202, doi. 10.1002/jcc.25101
- By:
- Publication type:
- Article
5
Erratum: 'A solvation-free-energy functional: A reference-modified density functional formulation' [J. Comput. Chem. 2015, 36, 1359-1369].
- Published in:
- Journal of Computational Chemistry, 2015, v. 36, n. 26, p. 2009, doi. 10.1002/jcc.24035
- By:
- Publication type:
- Article
6
A solvation-free-energy functional: A reference-modified density functional formulation.
- Published in:
- Journal of Computational Chemistry, 2015, v. 36, n. 18, p. 1359, doi. 10.1002/jcc.23942
- By:
- Publication type:
- Article
7
Structural Stability Analysis of Proteins Using End-to-End Distance: A 3D-RISM Approach.
- Published in:
- J: Multidisciplinary Scientific Journal, 2022, v. 5, n. 1, p. 114, doi. 10.3390/j5010009
- By:
- Publication type:
- Article
8
Analysis of molecular dynamics simulations of 10-residue peptide, chignolin, using statistical mechanics: Relaxation mode analysis and three-dimensional reference interaction site model theory.
- Published in:
- Biophysics & Physicobiology, 2019, v. 16, n. 1, p. 407, doi. 10.2142/biophysico.16.0_407
- By:
- Publication type:
- Article