화학공학소재연구정보센터
검색결과 : 10건
No. Article
1 Two polyhedral frameworks of an M12L24 spherical complex revealed by replica-exchange molecular dynamics simulations
Tachi Y, Sato S, Yoneya M, Fujita M, Okamoto Y
Chemical Physics Letters, 714, 185, 2019
2 Propafenone effects on the stable structures of A beta(16-22) system
Tran L, Ngo ST, Nguyen MT
Chemical Physics Letters, 696, 55, 2018
3 Structural characterization of amorphous materials applied to low-k organosilicate materials
Raymunt AC, Clancy P
Thin Solid Films, 562, 411, 2014
4 Combining Coarse-Grained Protein Models with Replica-Exchange All-Atom Molecular Dynamics
Wabik J, Kmiecik S, Gront D, Kouza M, Kolinski A
International Journal of Molecular Sciences, 14(5), 9893, 2013
5 A Hamiltonian Replica Exchange Molecular Dynamics (MD) Method for the Study of Folding, Based on the Analysis of the Stabilization Determinants of Proteins
Meli M, Colombo G
International Journal of Molecular Sciences, 14(6), 12157, 2013
6 Intrinsically Disordered Proteins in a Physics-Based World
Click TH, Ganguly D, Chen JH
International Journal of Molecular Sciences, 11(12), 5293, 2010
7 A polyethylene chain investigated with replica exchange molecular dynamics simulation: Equilibrium lamellar thickness and melting point, ordering and free energy
Li T, Jiang ZT, Yan DD, Nies E
Polymer, 51(23), 5612, 2010
8 Folding of Trp-cage Mini Protein Using Temperature and Biasing Potential Replica-Exchange Molecular Dynamics Simulations
Kannan S, Zacharias M
International Journal of Molecular Sciences, 10(3), 1121, 2009
9 Exploring the energy landscape of protein folding using replica-exchange and conventional molecular dynamics simulations
Beck DAC, White GWN, Daggett V
Journal of Structural Biology, 157(3), 514, 2007
10 Replica exchange simulation of reversible folding/unfolding of the Trp-cage miniprotein in explicit solvent: On the structure and possible role of internal water
Paschek D, Nymeyer H, Garcia AE
Journal of Structural Biology, 157(3), 524, 2007