화학공학소재연구정보센터
검색결과 : 5건
No. Article
1 Structural and Kinetic Characterization of the Intrinsically Disordered Protein SeV N-TAIL through Enhanced Sampling Simulations
Bernetti M, Masetti M, Pietrucci F, Blackledge M, Jensen MR, Recanatini M, Mollica L, Cavalli A
Journal of Physical Chemistry B, 121(41), 9572, 2017
2 DFT-Derived Reactive Potentials for the Simulation of Activated Processes: the Case of CdTe and CdTe:S
Hu XL, Ciaglia R, Pietrucci F, Gallet GA, Andreoni W
Journal of Physical Chemistry B, 118(24), 6531, 2014
3 Multidimensional View of Amyloid Fibril Nucleation in Atomistic Detail
Baftizadeh F, Biarnes X, Pietrucci F, Affinito F, Laio A
Journal of the American Chemical Society, 134(8), 3886, 2012
4 Optimizing the Performance of Bias-Exchange Metadynamics: Folding a 48-Residue LysM Domain Using a Coarse-Grained Model
Cossio P, Marinelli F, Laio A, Pietrucci F
Journal of Physical Chemistry B, 114(9), 3259, 2010
5 Substrate Binding Mechanism of HIV-1 Protease from Explicit-Solvent Atomistic Simulations
Pietrucci F, Marinelli F, Carloni P, Laio A
Journal of the American Chemical Society, 131(33), 11811, 2009