Benchmarking the ability of novel compounds to inhibit SARS-CoV-2 main protease using steered molecular dynamics simulations. - Rahul Singh; Vijay Kumar Bhardwaj; Pralay Das; Dhananjay Bhattacherjee; Grigory V. Zyryanov; Rituraj Purohit (Comput. Biol. Medicine, 2022)