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InChI-based optimal descriptors: QSAR analysis of fullerene[C60]-based HIV-1 PR inhibitors by correlation balance

Andrey A. ToropovInstitute of Geology and Geophysics, 100041, Khodzhibaev St. 49, Tashkent, Uzbekistan. [email protected]Alla P. ToropovaIstituto di Ricerche Farmacologiche Mario Negri, 20156, Via La Masa 19, Milano, ItalyEmilio BenfenatiIstituto di Ricerche Farmacologiche Mario Negri, 20156, Via La Masa 19, Milano, ItalyDanuta LeszczyńskaInterdisciplinary Nanotoxicity Center, Department of Chemistry, Jackson State University, 1400 J. R. Lynch Street, P.O. Box 17910, Jackson, MS 39217, USAJerzy LeszczyńskiInterdisciplinary Nanotoxicity Center, Department of Chemistry, Jackson State University, 1400 J. R. Lynch Street, P.O. Box 17910, Jackson, MS 39217, USA

European Journal of Medicinal Chemistryjournal2010en

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Computational Drug Discovery Methods Machine Learning in Materials Science Protein Structure and Dynamics

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DOI: 10.1016/j.ejmech.2009.12.037

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