화학공학소재연구정보센터
검색결과 : 8건
No. Article
1 Effects and limitations of a nucleobase-driven backmapping procedure for nucleic acids using steered molecular dynamics
Poblete S, Bottaro S, Bussi G
Biochemical and Biophysical Research Communications, 498(2), 352, 2018
2 RNA Structural Dynamics As Captured by Molecular Simulations: A Comprehensive Overview
Sponer J, Bussi G, Krepl M, Banas P, Bottaro S, Cunha RA, Gil-Ley A, Pinamonti G, Poblete S, Jureacka P, Walter NG, Otyepka M
Chemical Reviews, 118(8), 4177, 2018
3 Bowl Inversion of Surface-Adsorbed Sumanene
Jaafar R, Pignedoli CA, Bussi G, Ait-Mansour K, Groening O, Amaya T, Hirao T, Fasel R, Ruffieux P
Journal of the American Chemical Society, 136(39), 13666, 2014
4 Role of the Subunit Interactions in the Conformational Transitions in Adult Human Hemoglobin: An Explicit Solvent Molecular Dynamics Study
Yusuff OK, Babalola JO, Bussi G, Raugei S
Journal of Physical Chemistry B, 116(36), 11004, 2012
5 RNA Unwinding from Reweighted Pulling Simulations
Colizzi F, Bussi G
Journal of the American Chemical Society, 134(11), 5173, 2012
6 Trans-cis Switching Mechanisms in Proline Analogues and Their Relevance for the Gating of the 5-HT3 Receptor
Melis C, Bussi G, Lummis SCR, Molteni C
Journal of Physical Chemistry B, 113(35), 12148, 2009
7 Ensemble of Transition State Structures for the Cis-Trans Isomerization of N-Methylacetamide
Mantz YA, Branduardi D, Bussi G, Parrinello M
Journal of Physical Chemistry B, 113(37), 12521, 2009
8 Free-energy landscape for beta hairpin folding from combined parallel tempering and metadynamics
Bussi G, Gervasio FL, Laio A, Parrinello M
Journal of the American Chemical Society, 128(41), 13435, 2006