High-resolution mining of the SARS-CoV-2 main protease conformational space: supercomputer-driven unsupervised adaptive sampling.
Autor: | Jaffrelot Inizan, Théo, Célerse, Frédéric, Adjoua, Olivier, El Ahdab, Dina, Jolly, Luc-Henri, Liu, Chengwen, Ren, Pengyu, Montes, Matthieu, Lagarde, Nathalie, Lagardεave;re, Louis, Monmarché, Pierre, Piquemal, Jean-Philip |
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Zdroj: | Chemical Science; 4/7/2021, Vol. 12 Issue 13, p4889-4907, 19p |
Databáze: | Complementary Index |
Externí odkaz: |