화학공학소재연구정보센터
검색결과 : 24건
No. Article
1 Simulating Multiple Substrate-Binding Events by gamma-Glutamyltransferase Using Accelerated Molecular Dynamics
Oliva F, Flores-Canales JC, Pieraccini S, Morelli CF, Sironi M, Schiott B
Journal of Physical Chemistry B, 124(45), 10104, 2020
2 Halogen bonding in the framework of classical force fields: The case of chlorine
Franchini D, Dapiaggi F, Pieraccini S, Forni A, Sironi M
Chemical Physics Letters, 712, 89, 2018
3 Well-Tempered MetaDynamics based method to evaluate universal peptidomimetics
Gandini E, Dapiaggi F, Oliva F, Pieraccini S, Sironi M
Chemical Physics Letters, 706, 729, 2018
4 Assessment of DFT Functionals for QTAIM Topological Analysis of Halogen Bonds with Benzene
Forni A, Pieraccini S, Franchini D, Sironi M
Journal of Physical Chemistry A, 120(45), 9071, 2016
5 Modelling the effect of osmolytes on peptide mechanical unfolding
Pieraccini S, Conti S, Chaurasia S, Sironi M
Chemical Physics Letters, 578, 138, 2013
6 Molecular insights into the stabilization of protein-protein interactions with small molecule: The FKBP12-rapamycin-FRB case study
Chaurasia S, Pieraccini S, De Gonda R, Conti S, Sironi M
Chemical Physics Letters, 587, 68, 2013
7 Molecular modeling of the inhibition of protein-protein interactions with small molecules: The IL2-IL2R alpha case
Pieraccini S, De Gonda R, Sironi M
Chemical Physics Letters, 517(4-6), 217, 2011
8 Metadynamics Study of a beta-Hairpin Stability in Mixed Solvents
Saladino G, Pieraccini S, Rendine S, Recca T, Francescato P, Speranza G, Sironi M
Journal of the American Chemical Society, 133(9), 2897, 2011
9 A molecular dynamics study of an endostatin-derived peptide with antiangiogenic activity and of its mutants
Pieraccini S, Saladino G, Sironi M, Francescato P, Cattaneo MG, Vicentini LM, Speranza G, Manitto P
Chemical Physics Letters, 455(4-6), 311, 2008
10 Atomic level description of the protecting effect of osmolytes against thermal denaturation of proteins
Pieraccini S, Burgi L, Genoni A, Benedusi A, Sironi M
Chemical Physics Letters, 438(4-6), 298, 2007