Publications by authors named "Amir Hossein Arshia"
Comput Biol Med
December 2021
Article Synopsis
- The study focuses on identifying potential antiviral drugs targeting the main protease of SARS-CoV-2 using a generative LSTM network trained on 2.5 million compounds.
- After refining the network over ten generations, the top four candidates were selected based on strong binding interactions with critical protease residues, validated by molecular docking simulations.
- Further simulations confirmed the stability and efficacy of these candidates, suggesting their potential as inhibitors, though additional testing in biological settings is necessary.
