Sfoglia per Autore
Host-guest inclusion complexes between anticancer drugs and beta-cytclodextrin: computational studies.
2003-01-01 Fermeglia, Maurizio; Ferrone, Marco; Lodi, A.; Pricl, Sabrina
Molecular dynamics and free energy analyses of the interactions between beta-cyclodextrin and some anticancer drugs.
2003-01-01 Pricl, Sabrina; Ferrone, Marco; Fermeglia, Maurizio; A., Lodi
Design, synthesis and characterization of folate-cyclodextrin bioconjugate for active drug delivery: results from combined computational and experimental efforts
2004-01-01 Pricl, Sabrina; Fermeglia, Maurizio; Coslanich, Alessandro; Ferrone, Marco; Paneni, Maria Silvia; Caliceti, P.; Salmaso, S.; Semenzato, S.
Computer simulation of polymer-organoclay nanocomposites for packaging applications: From binding energy to interlayer spacing predictions
2004-01-01 Pricl, Sabrina; Scocchi, Giulio; Fermeglia, Maurizio; Ferrone, Marco; Coslanich, A.; Paneni, Maria Silvia
PVC/LDPE incompatible blends for industrial applications: A computational multiscale approach
2004-01-01 Fermeglia, Maurizio; Coslanich, A; Ferrone, Marco; Pricl, Sabrina; Paneni, Maria Silvia; Humar, T; Paglione, E.
A new mutation affecting the ATP pocket of kit receptor in patients with GIST showing acquired resistance to Imatinib: A coupled experimental and modeling investigation
2004-01-01 Pricl, Sabrina; Coslanich, A.; Fermeglia, Maurizio; Ferrone, Marco; Paneni, Maria Silvia; Tamborini, E.; Pilotti, S.; Pierotti, M. A.
A talk on the motor side. The free energy for mutating V186 and F244 to Leucine in beta-myosin and its ATP binding
2004-01-01 Paneni, Maria Silvia; Ferrone, Marco; Coslanich, A:; Fermeglia, Maurizio; Pricl, Sabrina; Miertus, S.; Frecer, V.; Carniel, E.; Mestroni, L.
Is tailor-fitting always the best choice? The case of mutations in GISTs and Imatinib
2004-01-01 Pricl, Sabrina; Ferrone, Marco; Paneni, Maria Silvia; Tamborini, E.; Pilotti, S.; Pierotti, M. A.
Molecular modeling of hydrogen storage in carbon nanotubes: A combined molecular dynamics/ab initio orbital study
2004-01-01 Pricl, Sabrina; Fermeglia, Maurizio; Ferrone, Marco; Coslanich, A:; Paneni, Maria Silvia; Romanel, F.
Prediction fo HIV-1 resistance to NNRITs: a computer-aided molecular-based rationale
2004-01-01 Pricl, Sabrina; Coslanich, Alessandro; Fermeglia, Maurizio; Ferrone, Marco; Paneni, Maria Silvia; Loddo, R.; Cabizza, A.; Sanna, G.; Murreddu, M.; La Colla, P.
Computer simulation of polypropylene/organoclay nanocomposites: characterization of atomic scale structure and prediction of binding energy
2004-01-01 Toth, Radovan; Coslanich, A.; Ferrone, Marco; Fermeglia, Maurizio; Pricl, Sabrina; Miertus, S.; Chiellini, E.
Estimation of the binding energy in random poly(butylene terephtalate-co-thiodiethylene terephtalate) copolyesters/clay nanocomposites via molecular simulations
2004-01-01 Fermeglia, Maurizio; Ferrone, Marco; Pricl, Sabrina
Genotype-phenotype correlations of myosin mutations: a molecular simulation study
2004-01-01 Paneni, Maria Silvia; Ferrone, Marco; Pricl, Sabrina; Carniel, E.; Miertus, S.; Frecer, V.; Mestroni, L.
Design, synthesis and activity of hindered nucleoside analogs with anti-Flaviviridae activity, and their interaction with RdRp
2004-01-01 Pricl, Sabrina; Ferrone, Marco; Paneni, Maria Silvia; Angusti, A.; Manfredini, S.; La Colla, P.; Mura, M.
Analogies in imatinib-resistant threonine-to-isoleucine mutation in bcr-abl, kit and pdgfra: a combined experimental/computational approach
2004-01-01 Pricl, Sabrina; Coslanich, Alessandro; Fermeglia, Maurizio; Ferro, M.; Ferrone, Marco; Paneni, Maria Silvia; Tamborini, E.; Negri, T.; Lagonigro, S.; Greco, A.; Gabanti, E.; Pierotti, M. A.; Pilotti, S.
Antifungal and antimycobacterial activity of new N1-[1-aryl-2-(1H-imidazol-1-yl and 1H-1,2,4-triazol-1-yl)-ethylidene]-pyridine-2-carboxamidrazone derivatives: a combined experimental and computational approach
2004-01-01 Mamolo, MARIA GRAZIA; Zampieri, Daniele; Falagiani, V; Vio, Luciano; Fermeglia, Maurizio; Ferrone, Marco; Pricl, Sabrina; Banfi, Elena; Scialino, G.
Diblock copolymers for the automotive industry: the mesoscopic approach
2004-01-01 Coslanich, Alessandro; Fermeglia, Maurizio; Ferrone, Marco; Paneni, Maria Silvia; Pricl, Sabrina; Martinelli, L.; Sinesi, S.
P53 mutations in sporadic and NF1 related malignant peripheral nerve sheath tumors (MPNST): from clinical evidences to a molecular rationale
2004-01-01 Ferrone, Marco; Pricl, Sabrina; Paneni, Maria Silvia; Tamborini, E.; Pilotti, S.; Pierotti, M. A.
"Fatty" nucleoside analogs as HCV NS5b inhibitors
2004-01-01 Pricl, Sabrina; Fermeglia, Maurizio; Ferrone, Marco; Coslanich, Alessandro; Paneni, Maria Silvia; Manfredini, S.; Angusti, A.; La Colla, P.; Mura, M.
Upgrading polymeric materials from post industrial rejects: a multiscale simulation approach
2004-01-01 Coslanich, Alessandro; Fermeglia, Maurizio; Ferrone, Marco; Pricl, Sabrina; Paneni, Maria Silvia; Martinelli, L.; Sinesi, S.; Candus, M.
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