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Journal of Chemical Information and Modeling|January 14, 2026
BOLD-GPCRs: A Transformer-Powered App for Predicting Ligand Bioactivity and Mutational Effects across Class A GPCRsDavide Provasi, Kirill Konovalov, Nicholas Riina, et al.Scientific Reports|September 14, 2017
Dynamic and Kinetic Elements of µ-Opioid Receptor Functional SelectivityAbhijeet Kapoor, Gerard Martinez-Rosell, Davide Provasi, et al.Plos Computational Biology|October 25, 2011
Ligand-induced modulation of the free-energy landscape of G protein-coupled receptors explored by adaptive biasing techniquesDavide Provasi, Marta Camacho Artacho, Ana Negri, et al.Plos Computational Biology|January 25, 2019
Kinetic and thermodynamic insights into sodium ion translocation through the μ-opioid receptor from molecular dynamics and machine learning analysisXiaohu Hu, Yibo Wang, Amanda Hunkele, et al.The Journal of Biological Chemistry|October 19, 2017
Development of novel biosensors to study receptor-mediated activation of the G-protein α subunits Gs and GolfHideaki Yano, Davide Provasi, Ning Sheng Cai, et al.ACS Chemical Biology|February 4, 2016
Proposed Mode of Binding and Action of Positive Allosteric Modulators at Opioid ReceptorsYi Shang, Holly R Yeatman, Davide Provasi, et al.Blood|August 4, 2010
Closed headpiece of integrin αIIbβ3 and its complex with an αIIbβ3-specific antagonist that does not induce openingJieqing Zhu, Jianghai Zhu, Ana Negri, et al.Journal of Molecular Biology|March 29, 2011
Molecular determinants and thermodynamics of the amyloid precursor protein transmembrane domain implicated in Alzheimer's diseaseHao Wang, Laura Barreyro, Davide Provasi, et al.Scientific Reports|May 18, 2018
Molecular details of dimerization kinetics reveal negligible populations of transient µ-opioid receptor homodimers at physiological concentrationsDerya Meral, Davide Provasi, Diego Prada-Gracia, et al.Science Advances|April 17, 2024
Structural insights into the unexpected agonism of tetracyclic antidepressants at serotonin receptors 5-HT1eR and 5-HT1FRGregory Zilberg, Alexandra K Parpounas, Audrey L Warren, et al.Pageof 13