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List of works by Paolo Benedetti

A Pipeline To Enhance Ligand Virtual Screening: Integrating Molecular Dynamics and Fingerprints for Ligand and Proteins.

scientific article published on 10 September 2015

Design, synthesis and in vitro antitumor activity of new trans 2-[2-(heteroaryl)vinyl]-1,3-dimethylimidazolium iodides.

scientific article published on April 2004

Discovering New Casein Kinase 1d Inhibitors with an Innovative Molecular Dynamics Enabled Virtual Screening Workflow

scientific article published on 13 December 2018

Distant collaboration in drug discovery: the LINK3D project

scientific article

Exposition and reactivity optimization to predict sites of metabolism in chemicals.

scientific article published in January 2013

FLAP: GRID molecular interaction fields in virtual screening. validation using the DUD data set.

scientific article

Fiber-optic fourier transform mid-infrared reflectance spectroscopy: a suitable technique for in situ studies of mural paintings.

scientific article published on March 2007

From Experiments to a Fast Easy-to-Use Computational Methodology to Predict Human Aldehyde Oxidase Selectivity and Metabolic Reactions.

scientific article published on 14 December 2017

GBR compounds and mepyramines as cocaine abuse therapeutics: chemometric studies on selectivity using grid independent descriptors (GRIND).

scientific article published on April 2002

GRIND/ALMOND investigations on CysLT1 receptor antagonists of the quinolinyl(bridged)aryl type

scientific article

Inhibitor of ovarian cancer cells growth by virtual screening: a new thiazole derivative targeting human thymidylate synthase

scientific article

Isozyme-specific ligands for O-acetylserine sulfhydrylase, a novel antibiotic target

scientific article

Non-invasive identification of organic materials in wall paintings by fiber optic reflectance infrared spectroscopy: a statistical multivariate approach.

scientific article published on 17 September 2009

Structure-based rationalization of antitumor drugs mechanism of action by a MIF approach

Targeting cystalysin, a virulence factor of treponema denticola-supported periodontitis

scientific article

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