Publications by authors named "Kay Ansorg"

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Toward a Physically Motivated Force Field: Hydrogen Bond Directionality from a Symmetry-Adapted Perturbation Theory Perspective.
Maxim Tafipolsky, Kay Ansorg

J Chem Theory Comput· March 2016

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QM/MM investigations of organic chemistry oriented questions.
Thomas C Schmidt, Alexander Paasche, Christoph Grebner, Kay Ansorg, Johannes Becker

Top Curr Chem· March 2015

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Cation-π interactions: accurate intermolecular potential from symmetry-adapted perturbation theory.
Kay Ansorg, Maxim Tafipolsky, Bernd Engels

J Phys Chem B· September 2013

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The pentaphenylborole-2,6-lutidine adduct: a system with unusual thermochromic and photochromic properties.
Kay Ansorg, Holger Braunschweig, Ching-Wen Chiu, Bernd Engels, Daniela Gamon

Angew Chem Int Ed Engl· March 2011

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Atomistic insights into the inhibition of cysteine proteases: first QM/MM calculations clarifying the stereoselectivity of epoxide-based inhibitors.
Milena Mladenovic, Kay Ansorg, Reinhold F Fink, Walter Thiel, Tanja Schirmeister

J Phys Chem B· September 2008

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