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Journal of Chemical Theory and Computation|January 29, 2016
Toward a Physically Motivated Force Field: Hydrogen Bond Directionality from a Symmetry-Adapted Perturbation Theory PerspectiveMaxim Tafipolsky, Kay AnsorgThe Journal of Physical Chemistry. B|August 9, 2013
Cation-π interactions: accurate intermolecular potential from symmetry-adapted perturbation theoryKay Ansorg, Maxim Tafipolsky, Bernd EngelsThe Journal of Physical Chemistry. B|August 21, 2008
Atomistic insights into the inhibition of cysteine proteases: first QM/MM calculations clarifying the stereoselectivity of epoxide-based inhibitorsMilena Mladenovic, Kay Ansorg, Reinhold F Fink, et al.Topics in Current Chemistry|March 7, 2012
QM/MM investigations of organic chemistry oriented questionsThomas C Schmidt, Alexander Paasche, Christoph Grebner, et al.Pageof 1