Publications
“A new method for the gradient-based optimization of molecular complexes.”, Journal of Computational Chemistry, vol. 30, no. 9, pp. 1371-8, 2009.
, “A new Lamarckian genetic algorithm for flexible ligand-receptor docking.”, Journal of Computational Chemistry, vol. 31, no. 9, pp. 1911-8, 2010.
, “Infrared densitometry: a fast and non-destructive method for exact stratum corneum depth calculation for in vitro tape-stripping.”, Skin Pharmacology and Physiology, vol. 23, no. 4, pp. 183-92, 2010.
, “Influence of the application area on finite dose permeation in relation to drug type applied.”, Experimental Dermatology, vol. 21, no. 3, pp. 233-5, 2012.
, “An extended database of keratin binding.”, Journal of Pharmaceutical Sciences, vol. 100, no. 5, pp. 1712-26, 2011.
, “The role of corneocytes in skin transport revised--a combined computational and experimental approach.”, Pharmaceutical Research, vol. 26, no. 6, pp. 1379-97, 2009.
, “In-silico model of skin penetration based on experimentally determined input parameters. Part I: experimental determination of partition and diffusion coefficients.”, European Journal of Pharmaceutics and Biopharmaceutics, vol. 68, no. 2, pp. 352-67, 2008.
, “Predicting Putative Inhibitors of 17β-HSD1”, Molecular Informatics, vol. 29, pp. 695–705, 2010.
, “Influence of human skin specimens consisting of different skin layers on the result of in vitro permeation experiments.”, Skin Pharmacology and Physiology, vol. 21, no. 2, pp. 81-8, 2008.
, “Potential pitfalls in skin permeation experiments: influence of experimental factors and subsequent data evaluation.”, European Journal of Pharmaceutics and Biopharmaceutics, vol. 72, no. 2, pp. 324-31, 2009.
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