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Issue DateTitleAuthor(s)
6-Aug-2020Bioactive conformational ensemble server and database. A public framework to speed up in silico drug discovery.Zivanovic, Sanja; Bayarri, Genís; Colizzi, Francesco; Moreno, David; Gelpí Buchaca, Josep Lluís; Soliva, Robert; Hospital Gasch, Adam; Orozco López, Modesto
10-Jul-2020Exploring the Conformational Landscape of Bioactive Small MoleculesZivanovic, Sanja; Colizzi, Francesco; Moreno, David; Hospital Gasch, Adam; Soliva, Robert; Orozco López, Modesto
28-Aug-2020DFFR: A New Method for High-Throughput Recalibration of Automatic Force-Fields for DrugsMoreno, David; Zivanovic, Sanja; Colizzi, Francesco; Hospital Gasch, Adam; Aranda, Juan; Soliva, Robert; Orozco López, Modesto