화학공학소재연구정보센터
검색결과 : 32건
No. Article
1 Imidazole in Aqueous Solution: Hydrogen Bond Interactions and Structural Reorganization with Concentration
Pagliai M, Funghi G, Vassetti D, Procacci P, Chelli R, Cardini G
Journal of Physical Chemistry B, 123(18), 4055, 2019
2 Free Energy Reconstruction in Bidirectional Force Spectroscopy Experiments: The Effect of the Device Stiffness (vol 114, pg 2509, 2010)
Marsili S, Procacci P
Journal of Physical Chemistry B, 120(28), 7037, 2016
3 Conformational Landscape of N-Glycosylated Peptides Detecting Autoantibodies in Multiple Sclerosis, Revealed by Hamiltonian Replica Exchange
Guardiani C, Signorini GF, Livi R, Papini AM, Procacci P
Journal of Physical Chemistry B, 116(18), 5458, 2012
4 Intraligand Hydrophobic Interactions Rationalize Drug Affinities for Peptidyl-Prolyl Cis-Trans Isomerase Protein
Bizzarri M, Marsili S, Procacci P
Journal of Physical Chemistry B, 115(19), 6193, 2011
5 Free Energy Reconstruction in Bidirectional Force Spectroscopy Experiments: The Effect of the Device Stiffness
Marsili S, Procacci P
Journal of Physical Chemistry B, 114(7), 2509, 2010
6 Hummer and Szabo-like Potential of Mean Force Estimator for Bidirectional Nonequilibrium Pulling Experiments/Simulations
Nicolini P, Procacci P, Chelli R
Journal of Physical Chemistry B, 114(29), 9546, 2010
7 Fragment 101-108 of Myelin Oligodendrocyte Glycoprotein: A Possible Lead Compound for Multiple Sclerosis
Guardiani C, Marsili S, Procacci P, Livi R
Journal of the American Chemical Society, 131(47), 17176, 2009
8 Key role of the polarization anisotropy of water in modeling classical polarizable force fields
Piquemal JP, Chelli R, Procacci P, Gresh N
Journal of Physical Chemistry A, 111(33), 8170, 2007
9 Comment on "From subtle to substantial: Role of metal ions on pi-pi interactions"
Chelli R, Procacci P
Journal of Physical Chemistry B, 110(20), 10204, 2006
10 Self-healing umbrella sampling: A non-equilibrium approach for quantitative free energy calculations
Marsili S, Barducci A, Chelli R, Procacci P, Schettino V
Journal of Physical Chemistry B, 110(29), 14011, 2006