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Molecular design technique is adapted in this work to identify the optimal molecular structure which satisfies multiple product specification.
For 'substitution', computer aided molecular design technique has been applied to select inherently safer solvents for a solvent operation.
While designing optimal products using molecular design technique for a specific application, product superiority is the only factor considered during design.
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Fuzzy optimisation approach is applied into the molecular design techniques in this work.
Inverse product design techniques utilize molecular design techniques to predict the molecular structure of the product from the target properties.
Product superiority is usually the only factor considered while designing optimal products using molecular design techniques for specific applications.
The results indicate that optimal molecular design techniques permit the design of new organic compounds which increase energy recovery.
In the last section, recent developments and opportunities in the design of ionic liquids using molecular design techniques have been discussed.
On top of these, recent developments and opportunities in the design of ionic liquids using molecular design techniques have been discussed.
Subsequently, group contribution methods and molecular design techniques are employed to solve the reverse property prediction problem to design molecules possessing the optimal properties.
In this scenario, computer-aided molecular design techniques are offering important tools, mainly as a consequence of the increasing structural information available for these targets.
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