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Current Pharmaceutical Design|November 23, 2012
Protonation states and conformational ensemble in ligand-based QSAR modelingPier G De Benedetti
Journal of Computer-Aided Molecular Design|September 30, 2006
Inactive and active states and supramolecular organization of GPCRs: insights from computational modelingFrancesca Fanelli, Pier G De Benedetti
Drug Discovery Today|March 26, 2018
Computational modeling approaches to quantitative structure-binding kinetics relationships in drug discoveryPier G De Benedetti, Francesca Fanelli
Drug Discovery Today|October 5, 2014
Multiscale quantum chemical approaches to QSAR modeling and drug designPier G De Benedetti, Francesca Fanelli
Drug Discovery Today|August 17, 2010
Computational quantum chemistry and adaptive ligand modeling in mechanistic QSARPier G De Benedetti, Francesca Fanelli
Current Protein & Peptide Science|April 10, 2009
Ligand-receptor communication and drug designPier G De Benedetti, Francesca Fanelli
Journal of Chemical Information and Computer Sciences|September 23, 2003
Molecular dynamics simulations of the ligand-induced chemical information transfer in the 5-HT(1A) receptorMichele Seeber, Pier G De Benedetti, Francesca Fanelli
Current Protein & Peptide Science|April 10, 2009
Computational modeling of intramolecular and intermolecular communication in GPCRsFrancesca Fanelli, Pier G De Benedetti, Francesco Raimondi, et al.
Journal of the American Chemical Society|March 14, 2008
Mechanisms of inter- and intramolecular communication in GPCRs and G proteinsFrancesco Raimondi, Michele Seeber, Pier G De Benedetti, et al.
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