Sfoglia per Autore
VEGA ZZ : a versatile toolkit for drug design and protein modelling
2008 A. Pedretti, A. Mazzolari, G. Vistoli
Influence of ionization state on the activation of temocapril by hCES1: a molecular-dynamics study
2009 G. Vistoli, A. Pedretti, A. Mazzolari, C. Bolchi, B. Testa
In silico prediction of metabolism by human carboxylesterase-1 (hCES1) combining docking analyses and MD simulations
2009 G. Vistoli, A. Pedretti, A. Mazzolari, B. Testa
In silico prediction of human carboxylesterase-1 (hCES1) metabolism combining docking analyses and MD simulations
2010 G. Vistoli, A. Pedretti, A. Mazzolari, B. Testa
Homology modeling and metabolism prediction of human carboxylesterase-2 using docking analyses by GriDock : a parallelized tool based on AutoDock 4.0
2010 G. Vistoli, A. Pedretti, A. Mazzolari, B. Testa
Insights into the structural determinants required for high-affinity binding of chiral cyclopropane-containing ligands to α4β2-nicotinic acetylcholine receptors : an integrated approach to behaviorally active nicotinic ligands
2012 H. Zhang, J.B. Eaton, L. Yu, M. Nys, A. Mazzolari, R. van Elk, A.B. Smit, V. Alexandrov, T. Hanania, E. Sabath, A. Fedolak, D. Brunner, R.J. Lukas, G. Vistoli, C. Ulens, A.P. Kozikowski
Mode of interaction of 1,4-dioxane agonists at the M2 and M3 muscarinic receptor orthosteric sites
2014 F. Del Bello, A. Bonifazi, W. Quaglia, A. Mazzolari, E. Barocelli, S. Bertoni, R. Matucci, M. Nesi, A. Piergentili, G. Vistoli
Improvement of Topical Palmitoylethanolamide Anti-Inflammatory Activity by Pegylated Prodrugs
2015 D. Tronino, R. Russo, C. Ostacolo, A. Mazzolari, C. De Caro, C. Avagliano, S. Laneri, G. La Rana, A. Sacchi, F. Della Valle, G. Vistoli, A. Calignano
Enhancing the reliability of GPCR models by accounting for flexibility of their pro-containing helices : The case of the human mAChR1 receptor
2015 A. Pedretti, A. Mazzolari, C. Ricci, G. Vistoli
IN SILICO APPROACHES IN DRUG DESIGN AND DEVELOPMENT: APPLICATIONS TO RATIONAL LIGAND DESIGN AND METABOLISM PREDICTION
2015 A. Mazzolari
Structural Effects of Some Relevant Missense Mutations on the MECP2-DNA Binding : a MD Study Analyzed by Rescore+, a Versatile Rescoring Tool of the VEGA ZZ Program
2016 A. Pedretti, C. Granito, A. Mazzolari, G. Vistoli
Carbachol dimers as homobivalent modulators of muscarinic receptors
2016 R. Matucci, M. Nesi, M.V. Martino, C. Bellucci, D. Manetti, E. Ciuti, A. Mazzolari, S. Dei, L. Guandalini, E. Teodori, G. Vistoli, M.N. Romanelli
Serum albumin as a probe for testing the selectivity of irreversible cysteine protease inhibitors : the case of vinyl sulfones
2016 L. Regazzoni, S. Colombo, A. Mazzolari, G. Vistoli, M. Carini
Computational approaches in the rational design of improved carbonyl quenchers : focus on histidine containing dipeptides
2016 G. Vistoli, M. Colzani, A. Mazzolari, D.D. Maddis, G. Grazioso, A. Pedretti, M. Carini, G. Aldini
The replacement of the 2-methoxy substituent of N-((6,6-diphenyl-1,4-dioxan-2-yl)methyl)-2-(2-methoxyphenoxy)ethan-1-amine improves the selectivity for 5-HT1A receptor over alpha(1)-adrenoceptor and D-2-like receptor subtypes
2017 F. Del Bello, A. Bonifazi, M. Giannella, G. Giorgioni, A. Piergentili, R. Petrelli, C. Cifani, M.V. Micioni Di Bonaventura, T.M. Keck, A. Mazzolari, G. Vistoli, A. Cilia, E. Poggesi, R. Matucci, W. Quaglia
Quenching activity of carnosine derivatives towards reactive carbonyl species: Focus on αâ(methylglyoxal) and βâ(malondialdehyde) dicarbonyls
2017 G. Vistoli, M. Colzani, A. Mazzolari, E. Gilardoni, C. Rivaletto, M. Carini, G. Aldini
A capture method based on the VC1 domain reveals new binding properties of the human receptor for advanced glycation end products (RAGE)
2017 G. Degani, A.A. Altomare, M. Colzani, C. Martino, A. Mazzolari, G. Fritz, G. Vistoli, L. Popolo, G. Aldini
Data from docking simulations to develop an efficient strategy able to evaluate the interactions between RAGE and MDA-induced albumin adducts
2017 A. Mazzolari, C. Coppa, A. Altomare, G. Degani, G. Vistoli
Binding space concept : a new approach to enhance the reliability of docking scores and its application to predicting butyrylcholinesterase hydrolytic activity
2017 G. Vistoli, A. Mazzolari, B. Testa, A. Pedretti
Pharmacokinetic profile of bilberry anthocyanins in rats and the role of glucose transporters : LC-MS/MS and computational studies
2017 G. Baron, A. Altomare, L. Regazzoni, V. Redaelli, S. De Grandi, A. Riva, P. Morazzoni, A. Mazzolari, M. Carini, G. Vistoli, G. Aldini
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