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	301.	eTOXlab, an open source modeling framework for implementing predictive models in production environments. [electronic resource] by Carrió, Pau López, Oriol Sanz, Ferran Pastor, Manuel Producer: 20150316 In: Journal of cheminformatics vol. 7 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	302.	Proteochemometric modelling coupled to in silico target prediction: an integrated approach for the simultaneous prediction of polypharmacology and binding affinity/potency of small molecules. [electronic resource] by Paricharak, Shardul Cortés-Ciriano, Isidro IJzerman, Adriaan P Malliavin, Thérèse E Bender, Andreas Producer: 20150430 In: Journal of cheminformatics vol. 7 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	303.	A document processing pipeline for annotating chemical entities in scientific documents. [electronic resource] by Campos, David Matos, Sérgio Oliveira, José L Producer: 20150326 In: Journal of cheminformatics vol. 7 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	304.	Incorporating domain knowledge in chemical and biomedical named entity recognition with word representations. [electronic resource] by Munkhdalai, Tsendsuren Li, Meijing Batsuren, Khuyagbaatar Park, Hyeon Ah Choi, Nak Hyeon Ryu, Keun Ho Producer: 20150326 In: Journal of cheminformatics vol. 7 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	305.	Wikipedia Chemical Structure Explorer: substructure and similarity searching of molecules from Wikipedia. [electronic resource] by Ertl, Peter Patiny, Luc Sander, Thomas Rufener, Christian Zasso, Michaël Producer: 20150327 In: Journal of cheminformatics vol. 7 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	306.	Luscus: molecular viewer and editor for MOLCAS. [electronic resource] by Kovačević, Goran Veryazov, Valera Producer: 20150518 In: Journal of cheminformatics vol. 7 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	307.	ChemDoodle Web Components: HTML5 toolkit for chemical graphics, interfaces, and informatics. [electronic resource] by Burger, Melanie C Producer: 20150718 In: Journal of cheminformatics vol. 7 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	308.	Atom-Atom-Path similarity and Sphere Exclusion clustering: tools for prioritizing fragment hits. [electronic resource] by Gobbi, Alberto Giannetti, Anthony M Chen, Huifen Lee, Man-Ling Producer: 20150413 In: Journal of cheminformatics vol. 7 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	309.	QSAR DataBank repository: open and linked qualitative and quantitative structure-activity relationship models. [electronic resource] by Ruusmann, V Sild, S Maran, U Producer: 20150625 In: Journal of cheminformatics vol. 7 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	310.	The influence of negative training set size on machine learning-based virtual screening. [electronic resource] by Kurczab, Rafał Smusz, Sabina Bojarski, Andrzej J Producer: 20140630 In: Journal of cheminformatics vol. 6 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	311.	Self organising hypothesis networks: a new approach for representing and structuring SAR knowledge. [electronic resource] by Hanser, Thierry Barber, Chris Rosser, Edward Vessey, Jonathan D Webb, Samuel J Werner, Stéphane Producer: 20140624 In: Journal of cheminformatics vol. 6 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	312.	CH5M3D: an HTML5 program for creating 3D molecular structures. [electronic resource] by Earley, Clarke W Producer: 20131202 In: Journal of cheminformatics vol. 5 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	313.	9th German Conference on Chemoinformatics. [electronic resource] by Fechner, Uli Publication details: Journal of cheminformatics Mar 2014 In: Journal of cheminformatics vol. 6 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	314.	Structure-activity relationship analysis on the basis of matched molecular pairs. [electronic resource] by Wassermann, Anne Mai Publication details: Journal of cheminformatics Mar 2014 In: Journal of cheminformatics vol. 6 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	315.	Combining pharmacophore- and MD-based modelling for phase II metabolism prediction. [electronic resource] by Rakers, Christin Wolber, Gerhard Publication details: Journal of cheminformatics Mar 2014 In: Journal of cheminformatics vol. 6 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	316.	Validated scoring of halogen bonding in molecular design. [electronic resource] by Zimmermann, Mo Lange, A Boeckler, Fm Publication details: Journal of cheminformatics Mar 2014 In: Journal of cheminformatics vol. 6 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	317.	Simulating "soft" electronics. [electronic resource] by Clark, Tim Publication details: Journal of cheminformatics Mar 2014 In: Journal of cheminformatics vol. 6 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	318.	Balancing selectivity vs stability using molecular dynamics and umbrella sampling. [electronic resource] by Mortier, Jeremie Nyakatura, Elisabeth K Miettinen, Markus Baldauf, Carsten Wolber, Gerhard Koksch, Beate Publication details: Journal of cheminformatics Mar 2014 In: Journal of cheminformatics vol. 6 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	319.	Membrane simulation analysis using Voronoi tessellation. [electronic resource] by Lukat, Gunther Sommer, Björn Krüger, Jens Publication details: Journal of cheminformatics Mar 2014 In: Journal of cheminformatics vol. 6 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	320.	Facing the challenges of computational target prediction. [electronic resource] by Schomburg, Karen T Rarey, Matthias Publication details: Journal of cheminformatics Mar 2014 In: Journal of cheminformatics vol. 6 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 676 results.