Rizwan Qureshi, Muhammad Irfan, Taimoor Muzaffar Gondal, Sheheryar Khan, Jia Wu, Muhammad Usman Hadi, John Heymach, Xiuning Le, Hong Yan, Tanvir Alam Heliyon. 2023;9(7). doi: 10.1016/j.heliyon.2023.e17575 https://www.cell.com/heliyon/abstract/S2405-8440(23)04783-7 Keywords Artificial intelligence Biotechnology Drug Discovery Graph neural networks Molecular dynamics simulation Molecule representation Reinforcement learning Library Collection(s) In Silico Download Citation BibTeX EndNote X3 XML EndNote 7 XML EndNote tagged Marc RIS