Enhancing molecular safety and health assessment via index smoothing and prioritisation

• Main Authors: Ten, Joon Yoon, Hassim, Mimi H., Promentilla, Michael Angelo B., Tan, Raymond R., Ng, Denny K. S., Chemmangattuvalappil, Nishanth G.
• Format: Article
• Published: Royal Society of Chemistry 2018
• Subjects: TP Chemical technology
• Online Access: http://eprints.utm.my/id/eprint/85942/; http://dx.doi.org/10.1039/c7me00073a

In recent decades, safety and health aspects have received much attention in the field of computer-aided molecular design (CAMD). To satisfy the more stringent requirements of regulating agencies, a product must not only achieve its desired function as defined by the customers but also meet safety a...