Sfoglia per Autore
The influence of simulation conditions in molecular dynamics investigations of model beta-sheet peptides
2004-01-01 Monticelli, L; Colombo, G
Characterization of the conformational space of a triple-stranded beta-sheet forming peptide with molecular dynamics simulations
2004-01-01 Soto, P; Colombo, G
beta-hairpin conformation of fibrillogenic peptides: Structure and alpha-beta transition mechanism revealed by molecular dynamics simulations
2004-01-01 Daidone, I; Simona, F; Roccatano, D; Broglia, Ra; Tiana, G; Colombo, G; Di Nola, A
Toward the understanding of the structure and dynamics of protein-carbohydrate interactions: molecular dynamics studies of the complexes between hevein and oligosaccharidic ligands
2004-01-01 Colombo, G; Meli, M; Canada, J; Asensio, Jl; Jimenez-Barbero, J
Thermodynamics of beta-amyloid fibril formation
2004-01-01 Tiana, G; Simona, F; Broglia, Ra; Colombo, G
Remote control of enzyme selectivity: the case of stevioside and steviolbioside
2004-01-01 Colombo, G; Riva, S; Danieli, B
All-atom folding simulations of the villin headpiece from stochastically selected coarse-grained structures
2004-01-01 De Mori, Gms; Micheletti, C; Colombo, G
Understanding the determinants of stability and folding of small globular proteins from their energetics
2004-01-01 Tiana, G; Simona, F; De Mori, Gms; Broglia, Ra; Colombo, G
Analyzing the free energy landscape of natural peptides: Insights from atomistic MD Simulations
2005-01-01 Monticelli, L; Tieleman, Dp; Colombo, G
A decoy set for the thermostable subdomain from chicken villin headpiece, comparison of different free energy estimators
2005-01-01 Fogolari, F; Tosatto, Sce; Colombo, G
Structure elucidation and 3D solution conformation of the antibiotic enduracidin determined by NMR spectroscopy and molecular dynamics.
2005-01-01 Castiglione, F; Marazzi, A; Meli, M; Colombo, G
Determinants of protein stability and folding: Comparative analysis of beta-lactoglobulins and liver basic fatty acid binding protein
2005-01-01 Ragona, L; Colombo, G; Catalano, M; Molinari, H
Study of the villin headpiece folding dynamics by combining coarse-grained Monte Carlo evolution and all-atom molecular dynamics
2005-01-01 De Mori, Gms; Colombo, G; Micheletti, C
Sequence dependence of amyloid fibril formation: Insights from molecular dynamics simulations
2005-01-01 de la Paz, Ml; de Mori, Gms; Serrano, L; Colombo, G
Mechanism of helix nucleation and propagation: Microscopic view from microsecond time scale MD simulations
2005-01-01 Monticelli, L; Tieleman, Dp; Colombo, G
Folding and mis-folding of peptides and proteins: Insights from molecular simulations
2005-01-01 De Mori, Gms; Meli, M; Monticelli, L; Colombo, G
Rational design of shepherdin, a novel anticancer agent
2005-01-01 Plescia, J; Salz, W; Xia, F; Pennati, M; Zaffaroni, N; Daidone, Mg; Meli, M; Dohi, T; Fortugno, P; Nefedova, Y; Gabrilovich, Di; Colombo, G; Altieri, Dc
Antileukemic activity of shepherdin, a novel targeted inhibitor of the survivin-HSP90 complex.
2005-01-01 Gyurkocza, B; Plescia, J; Toke, M; Greiner, D; Colombo, G; Lowry, Pa; Altieri, Dc
Molecular dynamics simulation of the aggregation of the core-recognition motif of the islet amylolid polypeptide in explicit water
2005-01-01 Colombo, G; Daidone, I; Gazit, E; Amadei, A; Di Nola, A
A dynamic perspective on the molecular recognition of chitooligosaccharide ligands by hevein domains
2005-01-01 Colombo, G; Meli, M; Canada, J; Asensio, Jl; Jimenez-Barbero, J
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