Challenges for chemistry in Ukraine after the war: Ukrainian science requires rebuilding and support

por Kondratov, Ivan S., Moroz, Yurii S., Gorgulla, Christoph, Grygorenko, Oleksandr O., Komarov, Igor V., Wagner, Gerhard, Tolmachev, Andrey A.
Publicado 2022

How Accurately Can We Predict the Melting Points of Drug-like Compounds?

por Tetko, Igor V., Sushko, Yurii, Novotarskyi, Sergii, Patiny, Luc, Kondratov, Ivan, Petrenko, Alexander E., Charochkina, Larisa, Asiri, Abdullah M.
Publicado 2014

Structure-based discovery of CFTR potentiators and inhibitors

por Liu, Fangyu, Kaplan, Anat Levit, Levring, Jesper, Einsiedel, Jürgen, Tiedt, Stephanie, Distler, Katharina, Omattage, Natalie S., Kondratov, Ivan S., Moroz, Yurii S., Pietz, Harlan L., Irwin, John J., Gmeiner, Peter, Shoichet, Brian K., Chen, Jue
Publicado 2023

Computationally driven discovery of SARS-CoV-2 M(pro) inhibitors: from design to experimental validation

por El Khoury, Léa, Jing, Zhifeng, Cuzzolin, Alberto, Deplano, Alessandro, Loco, Daniele, Sattarov, Boris, Hédin, Florent, Wendeborn, Sebastian, Ho, Chris, El Ahdab, Dina, Jaffrelot Inizan, Theo, Sturlese, Mattia, Sosic, Alice, Volpiana, Martina, Lugato, Angela, Barone, Marco, Gatto, Barbara, Macchia, Maria Ludovica, Bellanda, Massimo, Battistutta, Roberto, Salata, Cristiano, Kondratov, Ivan, Iminov, Rustam, Khairulin, Andrii, Mykhalonok, Yaroslav, Pochepko, Anton, Chashka-Ratushnyi, Volodymyr, Kos, Iaroslava, Moro, Stefano, Montes, Matthieu, Ren, Pengyu, Ponder, Jay W., Lagardère, Louis, Piquemal, Jean-Philip, Sabbadin, Davide
Publicado 2022