Your search returned 26 results.

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	1.	Machine learning techniques for in silico modeling of drug metabolism. [electronic resource] by Fox, Thomas Kriegl, Jan M Producer: 20070307 In: Current topics in medicinal chemistry vol. 6 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	2.	Structural, dynamic, and energetic aspects of long-range electron transfer in photosynthetic reaction centers. [electronic resource] by Kriegl, Jan M Nienhaus, G Ulrich Producer: 20040225 In: Proceedings of the National Academy of Sciences of the United States of America vol. 101 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	3.	Architectural repertoire of ligand-binding pockets on protein surfaces. [electronic resource] by Weisel, Martin Kriegl, Jan M Schneider, Gisbert Producer: 20100608 In: Chembiochem : a European journal of chemical biology vol. 11 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	4.	Computer-aided drug design at Boehringer Ingelheim. [electronic resource] by Muegge, Ingo Bergner, Andreas Kriegl, Jan M Producer: 20170921 In: Journal of computer-aided molecular design vol. 31 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	5.	The impact of data integrity on decision making in early lead discovery. [electronic resource] by Beck, Bernd Seeliger, Daniel Kriegl, Jan M Producer: 20160728 In: Journal of computer-aided molecular design vol. 29 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	6.	Structural dynamics in the active site of murine neuroglobin and its effects on ligand binding. [electronic resource] by Nienhaus, Karin Kriegl, Jan M Nienhaus, G Ulrich Producer: 20040729 In: The Journal of biological chemistry vol. 279 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	7.	Mining electronic laboratory notebooks: analysis, retrosynthesis, and reaction based enumeration. [electronic resource] by Christ, Clara D Zentgraf, Matthias Kriegl, Jan M Producer: 20140317 In: Journal of chemical information and modeling vol. 52 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	8.	What can we learn from molecular dynamics simulations for GPCR drug design? [electronic resource] by Tautermann, Christofer S Seeliger, Daniel Kriegl, Jan M Producer: 20150224 In: Computational and structural biotechnology journal vol. 13 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	9.	Computational approaches to predict drug metabolism. [electronic resource] by Czodrowski, Paul Kriegl, Jan M Scheuerer, Stefan Fox, Thomas Producer: 20090608 In: Expert opinion on drug metabolism & toxicology vol. 5 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	10.	Form follows function: shape analysis of protein cavities for receptor-based drug design. [electronic resource] by Weisel, Martin Proschak, Ewgenij Kriegl, Jan M Schneider, Gisbert Producer: 20090807 In: Proteomics vol. 9 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	11.	Self-organizing fuzzy graphs for structure-based comparison of protein pockets. [electronic resource] by Reisen, Felix Weisel, Martin Kriegl, Jan M Schneider, Gisbert Producer: 20110524 In: Journal of proteome research vol. 9 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	12.	Structural dynamics of myoglobin: effect of internal cavities on ligand migration and binding. [electronic resource] by Nienhaus, Karin Deng, Pengchi Kriegl, Jan M Nienhaus, G Ulrich Producer: 20031002 In: Biochemistry vol. 42 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	13.	Charge recombination and protein dynamics in bacterial photosynthetic reaction centers entrapped in a sol-gel matrix. [electronic resource] by Kriegl, Jan M Forster, Florian K Nienhaus, G Ulrich Producer: 20040505 In: Biophysical journal vol. 85 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	14.	A support vector machine approach to classify human cytochrome P450 3A4 inhibitors. [electronic resource] by Kriegl, Jan M Arnhold, Thomas Beck, Bernd Fox, Thomas Producer: 20051026 In: Journal of computer-aided molecular design vol. 19 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	15.	A composite model for HERG blockade. [electronic resource] by Kramer, Christian Beck, Bernd Kriegl, Jan M Clark, Timothy Producer: 20080723 In: ChemMedChem vol. 3 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	16.	Structural dynamics of myoglobin: spectroscopic and structural characterization of ligand docking sites in myoglobin mutant L29W. [electronic resource] by Nienhaus, Karin Deng, Pengchi Kriegl, Jan M Nienhaus, G Ulrich Producer: 20031002 In: Biochemistry vol. 42 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	17.	Ligand dynamics in a protein internal cavity. [electronic resource] by Kriegl, Jan M Nienhaus, Karin Deng, Pengchi Fuchs, Jochen Nienhaus, G Ulrich Producer: 20030722 In: Proceedings of the National Academy of Sciences of the United States of America vol. 100 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	18.	Multivariate modeling of cytochrome P450 3A4 inhibition. [electronic resource] by Kriegl, Jan M Eriksson, Lennart Arnhold, Thomas Beck, Bernd Johansson, Erik Fox, Thomas Producer: 20050722 In: European journal of pharmaceutical sciences : official journal of the European Federation for Pharmaceutical Sciences vol. 24 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	19.	Designing Multi-target Compound Libraries with Gaussian Process Models. [electronic resource] by Bieler, Michael Reutlinger, Michael Rodrigues, Tiago Schneider, Petra Kriegl, Jan M Schneider, Gisbert Producer: 20180212 In: Molecular informatics vol. 35 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	20.	Probing electric fields in protein cavities by using the vibrational stark effect of carbon monoxide. [electronic resource] by Lehle, Hartwig Kriegl, Jan M Nienhaus, Karin Deng, Pengchi Fengler, Stephanus Nienhaus, G Ulrich Producer: 20050706 In: Biophysical journal vol. 88 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)

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Your search returned 26 results.