11 citations · 21 across the 2 of their papers we have counts for
3 papers
AlphaFold Accelerates Artificial Intelligence Powered Drug Discovery: Efficient Discovery of a Novel Cyclin-dependent Kinase 20 (CDK20) Small Molecule Inhibitor
Feng Ren, Xiao Ding, Min Zheng +19
The AlphaFold computer program predicted protein structures for the whole human genome, which has been considered as a remarkable breakthrough both in artificial intelligence (AI)…
Chemistry42: An AI-based platform for de novo molecular design
Yan A. Ivanenkov, Alex Zhebrak, Dmitry Bezrukov +7
Chemistry42 is a software platform for de novo small molecule design that integrates Artificial Intelligence (AI) techniques with computational and medicinal chemistry methods. Che…
Molecular Sets (MOSES): A Benchmarking Platform for Molecular Generation Models
Daniil Polykovskiy, Alexander Zhebrak, Benjamin Sanchez-Lengeling +13
Generative models are becoming a tool of choice for exploring the molecular space. These models learn on a large training dataset and produce novel molecular structures with simila…