Quantum Chemical Drug Research

Dr. Irina Kufareva and her colleagues from UC San Diego have investigated quantum chemical approaches to computational drug research.

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Twin Polymerization – A Theoretical Study on Combining Chemical Reactivity with Structure Formation

A. Auer and co-workers have now shown the application of atomistic calculations to unravel the elementary steps of the novel twin-polymerization reaction.

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When Polymers Bite Back: A Kinetic Model for Suspension Polymerization

The free-radical polymerization of vinyl chloride is investigated using quantum chemical methods.

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