Retrosynthesis from transforms to predictive sustainable chemistry and nanotechnology: a brief tutorial review
Alicja Mikołajczyk, Uladzislau Zhdan, Sylvain Antoniotti, Adam Smoliński, Karolina Jagiełło, Piotr Skurski, Moussab Harb, Tomasz Puzyn, Jarosław Polański
Abstract
Retrosynthesis is a tool initially developed to simplify the planning of the synthesis of organic molecules. With the progress of computer-aided synthesis design (CASD), its development will be predictive green and sustainable CASD.
Topics & Concepts
Retrosynthetic analysisNanotechnologySustainable developmentComputer scienceManagement scienceChemistryEngineeringMaterials scienceOrganic chemistryEcologyTotal synthesisBiologyChemistry and Chemical EngineeringProcess Optimization and IntegrationMachine Learning in Materials Science