High Throughput Virtual Screening to Discover Inhibitors of the Main Protease of the Coronavirus SARS-CoV-2

by Olujide O. Olubiyi, Maryam Olagunju, Monika Keutmann, Jennifer Loschwitz, Birgit Strodel
Published 2020-07-01

Dataset of AMBER force field parameters of drugs, natural products and steroids for simulations using GROMACS

by Jennifer Loschwitz, Anna Jäckering, Monika Keutmann, Maryam Olagunju, Olujide O. Olubiyi, Birgit Strodel
Published 2021-04-01