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Theoretical and experimental studies on the interaction of biphenyl ligands with human and murine PD-L1: Up-to-date clues for drug design.
Donati G, D'Amore VM, Russomanno P, Cerofolini L, Amato J, Marzano S, Salobehaj M, Rizzo D, Assoni G, Carotenuto A, La Pietra V, Arosio D, Seneci P, Fragai M, Brancaccio D, Di Leva FS, Marinelli L. Donati G, et al. Among authors: fragai m. Comput Struct Biotechnol J. 2023 Jun 8;21:3355-3368. doi: 10.1016/j.csbj.2023.06.006. eCollection 2023. Comput Struct Biotechnol J. 2023. PMID: 37384351 Free PMC article.
NMR quality control of fragment libraries for screening.
Sreeramulu S, Richter C, Kuehn T, Azzaoui K, Blommers MJJ, Del Conte R, Fragai M, Trieloff N, Schmieder P, Nazaré M, Specker E, Ivanov V, Oschkinat H, Banci L, Schwalbe H. Sreeramulu S, et al. Among authors: fragai m. J Biomol NMR. 2020 Nov;74(10-11):555-563. doi: 10.1007/s10858-020-00327-9. Epub 2020 Jun 12. J Biomol NMR. 2020. PMID: 32533387 Free PMC article.
A Calix[4]arene Gd(III) Complex Endowed with High Stability, Relaxivity, and Binding Affinity to Serum Albumin This work was supported by CNR (Programma M.U.R.S.T. - Chimica Legge 95/95) "Agenti di contrasto, di shift e sonde luminescenti". We thank C.I.M. (Centro Interdipartimentale Misure) dell'Università di Parma for the NMR and mass spectroscopy facilities.
Aime S, Barge A, Botta M, Casnati A, Fragai M, Luchinat C, Ungaro R. Aime S, et al. Among authors: fragai m. Angew Chem Int Ed Engl. 2001 Dec 17;40(24):4737-4739. doi: 10.1002/1521-3773(20011217)40:24<4737::aid-anie4737>3.0.co;2-w. Angew Chem Int Ed Engl. 2001. PMID: 12404400 No abstract available.
NMR-based techniques in the hit identification and optimisation processes.
Pellecchia M, Becattini B, Crowell KJ, Fattorusso R, Forino M, Fragai M, Jung D, Mustelin T, Tautz L. Pellecchia M, et al. Among authors: fragai m. Expert Opin Ther Targets. 2004 Dec;8(6):597-611. doi: 10.1517/14728222.8.6.597. Expert Opin Ther Targets. 2004. PMID: 15584865 Review.
Unraveling hidden regulatory sites in structurally homologous metalloproteases.
Udi Y, Fragai M, Grossman M, Mitternacht S, Arad-Yellin R, Calderone V, Melikian M, Toccafondi M, Berezovsky IN, Luchinat C, Sagi I. Udi Y, et al. Among authors: fragai m. J Mol Biol. 2013 Jul 10;425(13):2330-46. doi: 10.1016/j.jmb.2013.04.009. Epub 2013 Apr 11. J Mol Biol. 2013. PMID: 23583775
144 results