Anna-Pitschna E. Kunz

New functionalities in the GROMOS biomolecular simulation software

Wilfred F. van Gunsteren, Daan P. Geerke, Sereina Riniker, 2012, J. Comput. Chem..

Development of a nonlinear classical polarization model for liquid water and aqueous solutions: COS/D.

Anna-Pitschna E. Kunz, W. V. van Gunsteren, 2009, The journal of physical chemistry. A.

A comparison of methods to compute the potential of mean force.

Anna-Pitschna E. Kunz, W. V. van Gunsteren, D. Trzesniak, 2007, Chemphyschem : a European journal of chemical physics and physical chemistry.

A simple, efficient polarizable molecular model for liquid carbon tetrachloride

Anna-Pitschna E. Kunz, Andreas P. Eichenberger, Wilfred F. van Gunsteren, 2011 .

Refinement of Molecular Simulation methodology: Development of Polarisable Solvents and Techniques to Enhance configurational Sampling

Anna-Pitschna E. Kunz, 2011 .

Biomolecular structure refinement using the GROMOS simulation software

Jane R. Allison, Jožica Dolenc, Nathan Schmid, 2011, Journal of biomolecular NMR.

A one-site polarizable model for liquid chloroform: COS/C

Anna-Pitschna E. Kunz, W. V. van Gunsteren, Zhixiong Lin, 2010 .

A method for conformational sampling of loops in proteins based on adiabatic decoupling and temperature or force scaling.

Anna-Pitschna E. Kunz, W. V. van Gunsteren, 2011, Chemphyschem : a European journal of chemical physics and physical chemistry.

Enhanced sampling of particular degrees of freedom in molecular systems based on adiabatic decoupling and temperature or force scaling.

Wilfred F van Gunsteren, Anna-Pitschna E. Kunz, W. V. van Gunsteren, 2011, The Journal of chemical physics.

On the Calculation of the Dielectric Permittivity and Relaxation of Molecular Models in the Liquid Phase.

Wilfred F van Gunsteren, Sereina Riniker, Anna-Pitschna E. Kunz, 2011, Journal of chemical theory and computation.