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Linear and nonlinear 3D-QSAR approaches in tandem with ligand-based homology modeling as a computational strategy to depict the pyrazolo-triazolo-pyrimidine antagonists binding site of the human adenosine A2A receptor.
Michielan L, Bacilieri M, Schiesaro A, Bolcato C, Pastorin G, Spalluto G, Cacciari B, Klotz KN, Kaseda C, Moro S. Michielan L, et al. Among authors: moro s. J Chem Inf Model. 2008 Feb;48(2):350-63. doi: 10.1021/ci700300w. Epub 2008 Jan 24. J Chem Inf Model. 2008. PMID: 18215030
MMsINC: a large-scale chemoinformatics database.
Masciocchi J, Frau G, Fanton M, Sturlese M, Floris M, Pireddu L, Palla P, Cedrati F, Rodriguez-Tomé P, Moro S. Masciocchi J, et al. Among authors: moro s. Nucleic Acids Res. 2009 Jan;37(Database issue):D284-90. doi: 10.1093/nar/gkn727. Epub 2008 Oct 17. Nucleic Acids Res. 2009. PMID: 18931373 Free PMC article.
Pharmaceutical perspectives of nonlinear QSAR strategies.
Michielan L, Moro S. Michielan L, et al. Among authors: moro s. J Chem Inf Model. 2010 Jun 28;50(6):961-78. doi: 10.1021/ci100072z. J Chem Inf Model. 2010. PMID: 20527756 Review. No abstract available.
409 results