Navigating around Patented Routes by Preserving Specific Motifs along Computer-Planned Retrosynthetic Pathways

Planning chemical syntheses with deep neural networks and symbolic AI

Marwin Segler, Mark P. Waller · Nature · 2018 · 1.9K citations · Full text

Computing, Chemistry, Computer Science +16

Biocatalytic Asymmetric Synthesis of Chiral Amines from Ketones Applied to Sitagliptin Manufacture

Christopher K. Savile, Jacob M. Janey, Emily C. Mundorff et al. · Science · 2010 · 1.7K citations

Natural Sciences, Biotechnology, Chemistry +16

Computer-Assisted Design of Complex Organic Syntheses

E. J. Corey, W. Todd Wipke · Science · 1969 · 718 citations

Natural Sciences, Chemical Engineering, Chemistry +14

Efficient Syntheses of Diverse, Medicinally Relevant Targets Planned by Computer and Executed in the Laboratory

Tomasz Klucznik, Barbara Mikulak-Klucznik, Michael P. McCormack et al. · Chem · 2018 · 370 citations · Full text

Pharmacy, Medicinal Chemistry, Computational Medicinal Chemistry +11

A Palladium-Catalyzed Method for the Preparation of Indoles via the Fischer Indole Synthesis

Seble Wagaw, Bryant H. Yang, Stephen L. Buchwald · Journal of the American Chemical Society · 1999 · 277 citations

Natural Sciences, Chemistry, Medicinal Chemistry +12