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	501.	mRAISE: an alternative algorithmic approach to ligand-based virtual screening. [electronic resource] by von Behren, Mathias M Bietz, Stefan Nittinger, Eva Rarey, Matthias Producer: 20170614 In: Journal of computer-aided molecular design vol. 30 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	502.	Insights into the molecular mechanisms of Polygonum multiflorum Thunb-induced liver injury: a computational systems toxicology approach. [electronic resource] by Wang, Yin-Yin Li, Jie Wu, Zeng-Rui Zhang, Bo Yang, Hong-Bin Wang, Qin Cai, Ying-Chun Liu, Gui-Xia Li, Wei-Hua Tang, Yun Producer: 20180417 In: Acta pharmacologica Sinica vol. 38 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	503.	Multiway analysis methods applied to the fluorescence excitation-emission dataset for the simultaneous quantification of valsartan and amlodipine in tablets. [electronic resource] by Dinç, Erdal Ertekin, Zehra Ceren Büker, Eda Producer: 20180813 In: Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy vol. 184 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	504.	Deep Learning Enhancing Kinome-Wide Polypharmacology Profiling: Model Construction and Experiment Validation. [electronic resource] by Li, Xutong Li, Zhaojun Wu, Xiaolong Xiong, Zhaoping Yang, Tianbiao Fu, Zunyun Liu, Xiaohong Tan, Xiaoqin Zhong, Feisheng Wan, Xiaozhe Wang, Dingyan Ding, Xiaoyu Yang, Ruirui Hou, Hui Li, Chunpu Liu, Hong Chen, Kaixian Jiang, Hualiang Zheng, Mingyue Producer: 20201208 In: Journal of medicinal chemistry vol. 63 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	505.	Exposome-Explorer 2.0: an update incorporating candidate dietary biomarkers and dietary associations with cancer risk. [electronic resource] by Neveu, Vanessa Nicolas, Geneviève Salek, Reza M Wishart, David S Scalbert, Augustin Producer: 20200526 In: Nucleic acids research vol. 48 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	506.	A crystallographic perspective on sharing data and knowledge. [electronic resource] by Bruno, Ian J Groom, Colin R Producer: 20150625 In: Journal of computer-aided molecular design vol. 28 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	507.	Carbohydrate structure database merged from bacterial, archaeal, plant and fungal parts. [electronic resource] by Toukach, Philip V Egorova, Ksenia S Producer: 20160613 In: Nucleic acids research vol. 44 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	508.	Price-Focused Analysis of Commercially Available Building Blocks for Combinatorial Library Synthesis. [electronic resource] by Kalliokoski, Tuomo Producer: 20160725 In: ACS combinatorial science vol. 17 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	509.	Pred-hERG: A Novel web-Accessible Computational Tool for Predicting Cardiac Toxicity. [electronic resource] by Braga, Rodolpho C Alves, Vinicius M Silva, Meryck F B Muratov, Eugene Fourches, Denis Lião, Luciano M Tropsha, Alexander Andrade, Carolina H Producer: 20180116 In: Molecular informatics vol. 34 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	510.	A high-throughput, computational system to predict if environmental contaminants can bind to human nuclear receptors. [electronic resource] by Wang, Xiaoxiang Zhang, Xiaowei Xia, Pu Zhang, Junjiang Wang, Yuting Zhang, Rui Giesy, John P Shi, Wei Yu, Hongxia Producer: 20180605 In: The Science of the total environment vol. 576 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	511.	ChemDataExtractor: A Toolkit for Automated Extraction of Chemical Information from the Scientific Literature. [electronic resource] by Swain, Matthew C Cole, Jacqueline M Producer: 20170613 In: Journal of chemical information and modeling vol. 56 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	512.	mVOC 2.0: a database of microbial volatiles. [electronic resource] by Lemfack, Marie C Gohlke, Bjoern-Oliver Toguem, Serge M T Preissner, Saskia Piechulla, Birgit Preissner, Robert Producer: 20190813 In: Nucleic acids research vol. 46 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	513.	RIFM FRAGRANCE INGREDIENT SAFETY ASSESSMENT, 1-Oxaspiro[4.5]decan-2-one, 8-(1-methylethyl)-, trans-, CAS Registry Number 4625-90-5. [electronic resource] by Api, A M Belsito, D Botelho, D Bruze, M Burton, G A Buschmann, J Dagli, M L Date, M Dekant, W Deodhar, C Francis, M Fryer, A D Jones, L Joshi, K La Cava, S Lapczynski, A Liebler, D C O'Brien, D Patel, A Penning, T M Ritacco, G Romine, J Sadekar, N Salvito, D Schultz, T W Sipes, I G Sullivan, G Thakkar, Y Tokura, Y Tsang, S Producer: 20190114 In: Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association vol. 118 Suppl 1 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	514.	RIFM FRAGRANCE INGREDIENT SAFETY ASSESSMENT, 1-Methyl-2-(1-methylpropyl)cyclohexyl acetate, CAS Registry Number 72183-75-6. [electronic resource] by Api, A M Belsito, D Botelho, D Bruze, M Burton, G A Buschmann, J Dagli, M L Date, M Dekant, W Deodhar, C Francis, M Fryer, A D Jones, L Joshi, K La Cava, S Lapczynski, A Liebler, D C O'Brien, D Patel, A Penning, T M Ritacco, G Romine, J Sadekar, N Salvito, D Schultz, T W Sipes, I G Sullivan, G Thakkar, Y Tokura, Y Tsang, S Producer: 20190114 In: Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association vol. 118 Suppl 1 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	515.	RIFM fragrance ingredient safety assessment, (Z)-Octadec-9-enol, CAS Registry Number 143-28-2. [electronic resource] by Api, A M Belsito, D Botelho, D Bruze, M Burton, G A Buschmann, J Dagli, M L Date, M Dekant, W Deodhar, C Francis, M Fryer, A D Jones, L Joshi, K La Cava, S Lapczynski, A Liebler, D C O'Brien, D Patel, A Penning, T M Ritacco, G Romine, J Sadekar, N Salvito, D Schultz, T W Sipes, I G Sullivan, G Thakkar, Y Tokura, Y Tsang, S Producer: 20190114 In: Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association vol. 118 Suppl 1 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	516.	RIFM fragrance ingredient safety assessment, 1-oxaspiro[4.5]decan-2-one, 8-methyl-, CAS Registry Number 94201-19-1. [electronic resource] by Api, A M Belsito, D Botelho, D Bruze, M Burton, G A Buschmann, J Dagli, M L Date, M Dekant, W Deodhar, C Francis, M Fryer, A D Jones, L Joshi, K La Cava, S Lapczynski, A Liebler, D C O'Brien, D Patel, A Penning, T M Ritacco, G Romine, J Sadekar, N Salvito, D Schultz, T W Sipes, I G Sullivan, G Thakkar, Y Tokura, Y Tsang, S Producer: 20190114 In: Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association vol. 118 Suppl 1 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	517.	RIFM fragrance ingredient safety assessment 2-methyl-trans-2-butenoic acid, CAS Registry Number 80-59-1. [electronic resource] by Api, A M Belsito, D Botelho, D Browne, D Bruze, M Burton, G A Buschmann, J Dagli, M L Date, M Dekant, W Deodhar, C Francis, M Fryer, A D Joshi, K La Cava, S Lapczynski, A Liebler, D C O'Brien, D Parakhia, R Patel, A Penning, T M Ritacco, G Romine, J Salvito, D Schultz, T W Sipes, I G Sullivan, G Thakkar, Y Theophilus, E H Tiethof, A K Tokura, Y Tsang, S Wahler, J Producer: 20190114 In: Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association vol. 118 Suppl 1 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	518.	Virtual screening for quorum-sensing inhibitors of Pseudomonas fluorescens P07 from a food-derived compound database. [electronic resource] by Ding, T Li, T Li, J Producer: 20191030 In: Journal of applied microbiology vol. 127 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	519.	The role of metabolomics in characterizing the human exposome. [electronic resource] by Athersuch, Toby J Producer: 20130114 In: Bioanalysis vol. 4 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	520.	MetDisease--connecting metabolites to diseases via literature. [electronic resource] by Duren, William Weymouth, Terry Hull, Tim Omenn, Gilbert S Athey, Brian Burant, Charles Karnovsky, Alla Producer: 20141002 In: Bioinformatics (Oxford, England) vol. 30 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)

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