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Multiscale computation delivers organophosphorus reactivity and stereoselectivity to immunoglobulin scavengers.
Mokrushina YA, Golovin AV, Smirnov IV, Chatziefthimiou SD, Stepanova AV, Bobik TV, Zalevsky AO, Zlobin AS, Konovalov KA, Terekhov SS, Stepanov AV, Pipiya SO, Shamborant OG, Round E, Belogurov AA Jr, Bourenkov G, Makarov AA, Wilmanns M, Xie J, Blackburn GM, Gabibov AG, Lerner RA. Mokrushina YA, et al. Among authors: stepanova av. Proc Natl Acad Sci U S A. 2020 Sep 15;117(37):22841-22848. doi: 10.1073/pnas.2010317117. Epub 2020 Aug 28. Proc Natl Acad Sci U S A. 2020. PMID: 32859757 Free PMC article.
Evolution of catalytic centers of antibodies by virtual screening of broad repertoire of mutants using supercomputer.
Golovin AV, Smirnov IV, Stepanova AV, Zalevskiy AO, Zlobin AS, Ponomarenko NA, Belogurov AA, Knorre VD, Hurs EN, Chatziefthimiou SD, Wilmanns M, Blackburn GM, Khomutov RM, Gabibov AG. Golovin AV, et al. Among authors: stepanova av. Dokl Biochem Biophys. 2017 Jul;475(1):245-249. doi: 10.1134/S1607672917040019. Epub 2017 Sep 2. Dokl Biochem Biophys. 2017. PMID: 28864894
Bulk ferromagnetism in cleavable van der Waals telluride NbFeTe2.
Stepanova AV, Mironov AV, Bogach AV, Azarevich AN, Presniakov IA, Sobolev AV, Pankratov DA, Zayakhanov VA, Starchikov SS, Verchenko VY, Shevelkov AV. Stepanova AV, et al. Chem Commun (Camb). 2024 May 2. doi: 10.1039/d4cc01160k. Online ahead of print. Chem Commun (Camb). 2024. PMID: 38693880
Fe-Rich Ferromagnetic Cleavable Van der Waals Telluride Fe5AsTe2.
Verchenko VY, Stepanova AV, Bogach AV, Mironov AV, Shevelkov AV. Verchenko VY, et al. Among authors: stepanova av. Inorg Chem. 2022 Jun 20;61(24):9224-9230. doi: 10.1021/acs.inorgchem.2c00800. Epub 2022 Jun 5. Inorg Chem. 2022. PMID: 35658443
22 results