검색결과 : 5건
| No. | Article |
|---|---|
| 1 |
Unbinding Kinetics of a p38 MAP Kinase Type II Inhibitor from Metadynamics Simulations Casasnovas R, Limongelli V, Tiwary P, Carloni P, Parrinello M Journal of the American Chemical Society, 139(13), 4780, 2017 |
| 2 |
Conformational Changes in the Epidermal Growth Factor Receptor: Role of the Transmembrane Domain Investigated by Coarse-Grained MetaDynamics Free Energy Lelimousin M, Limongelli V, Sansom MSP Journal of the American Chemical Society, 138(33), 10611, 2016 |
| 3 |
Funnel-Metadynamics and Solution NMR to Estimate Protein-Ligand Affinities Troussicot L, Guilliere F, Limongelli V, Walker O, Lancelin JM Journal of the American Chemical Society, 137(3), 1273, 2015 |
| 4 |
Investigating the Mechanism of Substrate Uptake and Release in the Glutamate Transporter Homologue Glt(Ph) through Metadynamics Simulations Grazioso G, Limongelli V, Branduardi D, Novellino E, De Micheli C, Cavalli A, Parrinello M Journal of the American Chemical Society, 134(1), 453, 2012 |
| 5 |
Structural and Conformational Requisites in DNA Quadruplex Groove Binding: Another Piece to the Puzzle Cosconati S, Marinelli L, Trotta R, Virno A, De Tito S, Romagnoli R, Pagano B, Limongelli V, Giancola C, Baraldi PG, Mayol L, Novellino E, Randazzo A Journal of the American Chemical Society, 132(18), 6425, 2010 |