Showing results (31-40 of 182) with videos related to
Sort By:
Pageof 19
Food Chemistry|July 21, 2015
Molecular modelling approach to evaluate poisoning of topoisomerase I by alternariol derivativesLuca Dellafiora, Chiara Dall'Asta, Gabriele Cruciani, et al.Chemistry & Biodiversity|November 26, 2009
In silico pKa prediction and ADME profilingGabriele Cruciani, Francesca Milletti, Loriano Storchi, et al.Scientific Reports|July 31, 2020
Virtual screening identifies broad-spectrum β-lactamase inhibitors with activity on clinically relevant serine- and metallo-carbapenemasesFrancesca Spyrakis, Matteo Santucci, Lorenzo Maso, et al.Molecular Pharmaceutics|January 10, 2012
BDDCS class prediction for new molecular entitiesFabio Broccatelli, Gabriele Cruciani, Leslie Z Benet, et al.Pharmaceuticals (Basel, Switzerland)|July 30, 2025
Target Mapping in Cancer: Ligandable Protein Pockets on 3D OncoPPI NetworksDaniela Trisciuzzi, Orazio Nicolotti, Gabriele Cruciani, et al.Organic & Biomolecular Chemistry|April 11, 2024
Use of ionic liquids in amidation reactions for proteolysis targeting chimera synthesisMichela Eleuteri, Jenny Desantis, Gabriele Cruciani, et al.Scientific Reports|December 20, 2017
Computational and biological profile of boronic acids for the detection of bacterial serine- and metallo-β-lactamasesMatteo Santucci, Francesca Spyrakis, Simon Cross, et al.Drug Discovery Today. Technologies|September 21, 2013
Exposition and reactivity optimization to predict sites of metabolism in chemicalsGabriele Cruciani, Massimo Baroni, Paolo Benedetti, et al.Journal of Chemical Information and Modeling|March 27, 2007
A common reference framework for analyzing/comparing proteins and ligands. Fingerprints for Ligands and Proteins (FLAP): theory and applicationMassimo Baroni, Gabriele Cruciani, Simone Sciabola, et al.Journal of Medicinal Chemistry|December 28, 2002
Surface descriptors for protein-ligand affinity predictionIsmael Zamora, Tudor Oprea, Gabriele Cruciani, et al.Pageof 19