Exhaustive exploration of the conformational landscape of small cyclic peptides using a robotics approach

Autor: Maud Jusot, Juan Cortés, Dirk Stratmann, Marc Vaisset, Jacques Chomilier

Publikováno v: Journal of Chemical Information and Modeling
Journal of Chemical Information and Modeling, American Chemical Society, 2018, 58 (11), pp.2355-2368. ⟨10.1021/acs.jcim.8b00375⟩
Journal of Chemical Information and Modeling, 2018, 58 (11), pp.2355-2368. ⟨10.1021/acs.jcim.8b00375⟩

International audience; Small cyclic peptides represent a promising class of therapeutic molecules with unique chemical properties. However, the poor knowledge of their structural characteristics makes their computational design and structure predict

Externí odkaz: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::f94a504bd9f6774baf97ae75bfee2039
https://hal.laas.fr/hal-01893751/document