» Chemie Deutschland

My research activities focus on the development and applications of computational methods for investigating structure, properties and reactivity of large and complex chemical systems. The spectrum of developed methods ranges from global structure optimization algorithms over combined quantum mechani
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www: http://www.marek-sierka.com/research/invited-talks

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» Chemistry Germany

A combined QM/MM approach has been developed that describes the reactive part of a chemical system quantum mechanically (QM) and its environment by analytical potential functions or force fields (MM). The QMPOT program which implements this method allows for a flexible combination of different softw
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www: http://www.marek-sierka.com/research/methods

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