In this paper we present novel theoretical and algorithmic developments for the solution of
mixed-integer optimization problems involving uncertainty, which can be posed as …

The best solution to computer-aided solvent and process design problems can be only
achieved by the simultaneous optimization of solvent molecules and process operating …

The limitations are addressed that emerge from the computer aided molecular design
(CAMD) applications in the optimal synthesis of solvents through a novel approach of …

A systematic procedure proposed here selects optimal solvent blends for nonreactive,
multicomponent absorption processes accounting for plant‐wide point source environmental …

This paper addresses the problem of optimally designing molecular products. A systematic
analysis framework is presented for transforming a class of optimal computer-aided …

In this work, we adapt the COSMO-RS and-SAC methods to solve computer-aided mixture
design (CAMxD) problems. Popular methods in CAMxD require the use of binary interaction …

Today, some established working fluids are being phased out due to new international
regulations on the use of environmentally harmful substances. With an ever-increasing cost …

This short communication presents a generic mathematical programming formulation for
computer-aided molecular design (CAMD). A given CAMD problem, based on target …

This paper presents an overview of the recent developments in the area of solvent design
using computer-aided molecular design (CAMD) tools. Effective CAMD approaches are …

We propose a processing alternative for replacing the traditional and environmentally
dangerous solvents (as monoethanolamine, diethanolamine) in the process of CO 2 …