Research and Development of Reaction By-product Prediction System

Especially when we think environment, safety, risk reduction, and responsible care, one of the most important things in synthetic process design is to estimate possibility of production of by-products. Therefore we are researching and developing a system to enumerate possible by-products by knowledge-based information engineering methodologies, and have succeeded in development of its basic functions. Moreover we are researching systematic arrangement of reaction information for new reaction discovery by using self-organization neural network. One of the our goal is to draw the map of chemical reactions.