A molecular design methodology by the simultaneous optimisation of performance, safety and health aspects
Computer aided molecular design (CAMD) techniques have been implemented to design molecules or mixtures that satisfy a set of desirable target properties as specified by the customers. Molecular physical and thermodynamic properties are often selected as the target properties during the design stage...
Main Authors: | Ten, J. Y., Hassim, M. H., Ng, D. K. S., Chemmangattuvalappil, N. G. |
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Format: | Article |
Published: |
Elsevier Ltd
2017
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Subjects: |
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