Полынский М.В. - Towards Artificial Intelligence in Chemistry via the Rational Design - Lecture 12

Machine Learning in Organic Synthesis. Robots in Chemistry. Deep Learning in Drug Design 00:00:19 Introduction 00:01:22 Organic Synthesis. Retrosynthetic Analysis 00:12:54 Machine Learning in Organic Synthesis 00:17:58 Predicting retrosynthetic pathways using transformer-based models and a hypergraph exploration strategy 00:28:45 Interactive Demonstration: Predicting Synthetic Routes with IBM RXN 00:37:26 Robots in Chemistry 01:07:04 Deep Learning in Drug Design Ссылка на плейлист: