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di jxl library [77 articles]

Articoli aggiunti di recente nella biblioteca di jxl .
  • An evaluation of selected global (Q)SARs/expert systems for the prediction of skin sensitisation potential
    SAR and QSAR in Environmental Research, Vol. 18, No. 5-6. (July 2007), pp. 515-541.
    by Patlewicz, , Aptula, , Uriarte, , Roberts, , Kern, , Gerberick, , Kimber, , Dearman, , Ryan, , Basketter,
    posted to skin sensitisation by jxl on 2008-07-01 16:21:32 as **
  • Causal inference in biomolecular pathways using a Bayesian network approach and an Implicit method
    Journal of Theoretical Biology, Vol. In Press, Corrected Proof
    by Ben, Afif Masmoudi, Ahmed Rebai
    posted to systems_biology_bayesiannetworks by jxl on 2008-06-23 16:09:21 as **
  • Classification of premalignant pancreatic cancer mass-spectrometry data using decision tree ensembles
    BMC Bioinformatics, Vol. 9 (11 June 2008), 275.
    by Guangtao Ge, William G Wong
    posted to ml_biology by jxl on 2008-06-16 09:48:54 as **
  • A Fully Computational Model for Predicting Percutaneous Drug Absorption
    J. Chem. Inf. Model., Vol. 46, No. 1. (23 January 2006), pp. 424-429.
    by D Neumann, O Kohlbacher, C Merkwirth, T Lengauer
    posted to skin by jxl on 2008-05-27 10:04:15 as ** along with 1 person ucbcjbm
  • A Comparison of Machine Learning Algorithms for Chemical Toxicity Classification Using a Simulated Multi-Scale Data Model
    BMC Bioinformatics, Vol. 9 (19 May 2008), 241.
    by Richard Judson, Fathi Elloumi, Woodrow R Setzer, Zhen Li, Imran Shah
    posted to toxicology ml by jxl on 2008-05-22 09:22:34 as **
  • Analyzing and visualizing expression data with Spotfire.
    Current protocols in bioinformatics / editoral board, Andreas D. Baxevanis ... [et al.], Vol. Chapter 7 (October 2004)
    by D Kaushal, CW Naeve
    posted to ml_vis by jxl on 2008-04-25 09:25:37 as **
  • Comparison of normalisation methods for surface-enhanced laser desorption and ionisation (SELDI) time-of-flight (TOF) mass spectrometry data
    BMC Bioinformatics, Vol. 9 (07 February 2008), 88.
    by Wouter Meuleman, Judith YMN Engwegen, Marie-Christine W Gast, Jos H Beijnen, Marcel JT Reinders, Lodewyk FA Wessels
    posted to modelling normalisation by jxl on 2008-04-02 16:11:12 as ****
  • Weight of Evidence: A Review of Concept and Methods
    Risk Analysis, Vol. 25, No. 6. (2005), pp. 1545-1557.
    by Douglas L Weed
    posted to woe by jxl on 2008-03-07 09:23:31 as ** along with 1 person wandall
  • Sampling and sensitivity analyses tools (SaSAT) for computational modelling
    Theoretical Biology and Medical Modelling, Vol. 5 (27 February 2008), 4.
    by Alexander Hoare, David G Regan, David P Wilson
    posted to modelling by jxl on 2008-03-05 09:32:22 as ** along with 2 people jyuh blloyd
  • Advanced Biological and Chemical Discovery (ABCD): Centralizing Discovery Knowledge in an Inherently Decentralized World
    J. Chem. Inf. Model., Vol. 47, No. 6. (26 November 2007), pp. 1999-2014.
    by DK Agrafiotis, S Alex, H Dai, A Derkinderen, M Farnum, P Gates, S Izrailev, EP Jaeger, P Konstant, A Leung, VS Lobanov, P Marichal, D Martin, DN Rassokhin, M Shemanarev, A Skalkin, J Stong, T Tabruyn, M Vermeiren, J Wan, XY Xu, X Yao
    posted to cheminformatics by jxl on 2008-02-27 16:08:41 as **
  • A Simple Statistical Parameter for Use in Evaluation and Validation of High Throughput Screening Assays.
    J Biomol Screen, Vol. 4, No. 2. (1999), pp. 67-73.
    by JH Zhang, TD Chung, KR Oldenburg
    posted to cytotoxicity by jxl on 2008-02-22 16:55:47 as ** along with 1 person Yanno
  • Quantitative high-throughput screening: a titration-based approach that efficiently identifies biological activities in large chemical libraries.
    Proc Natl Acad Sci U S A, Vol. 103, No. 31. (1 August 2006), pp. 11473-11478.
    by J Inglese, DS Auld, A Jadhav, RL Johnson, A Simeonov, A Yasgar, W Zheng, CP Austin
    posted to cytotoxicity by jxl on 2008-02-22 16:46:56 as read along with 2 people jyuh daevans
  • Integration of Structure-Activity Relationship and Artificial Intelligence Systems To Improve in Silico Prediction of Ames Test Mutagenicity
    J. Chem. Inf. Model., Vol. 47, No. 1. (22 January 2007), pp. 34-38.
    by P Mazzatorta, LA Tran, B Schilter, M Grigorov
    posted to chemoinformatics by jxl on 2007-10-25 14:37:29 as ***
  • In vitro approaches to develop weight of evidence (WoE) and mode of action (MoA) discussions with positive in vitro genotoxicity results
    Mutagenesis, Vol. 22, No. 3. (1 May 2007), pp. 161-175.
    by Dj Kirkland, M Aardema, N Banduhn, P Carmichael, R Fautz, J-R Meunier, S Pfuhler
    posted to chemoinformatics mutcar by jxl on 2007-08-09 17:21:08 as ** along with 1 group EC
  • ELUCIDATING MECHANISMS OF DRUG-INDUCED TOXICITY
    Nat Rev Drug Discov, Vol. 4, No. 5. (May 2005), pp. 410-420.
    by Daniel C Liebler, Peter F Guengerich
    posted to discovery drug by jxl on 2007-08-07 14:10:35 as ** along with 1 group EC
  • Local and Global Quantitative Structure-Activity Relationship Modeling and Prediction for the Baseline Toxicity
    J. Chem. Inf. Model., Vol. 47, No. 1. (22 January 2007), pp. 159-169.
    by H Yuan, Y Wang, Y Cheng
    posted to chemoinformatics by jxl on 2007-07-17 15:19:27 as ** along with 1 group EC
  • notes Structure-based classification of chemical reactions without assignment of reaction centers.
    J Chem Inf Model, Vol. 45, No. 6. (c 2005), pp. 1775-1783.
    by QY Zhang, J Aires-de-Sousa
    posted to joao molmap by jxl on 2007-07-17 09:45:00 as ** along with 1 group EC
  • notes Genome-Scale Classification of Metabolic Reactions: A Chemoinformatics Approach
    Angewandte Chemie International Edition, Vol. 45, No. 13. (2006), pp. 2066-2069.
    by Diogo ARS Latino, João Aires-De-Sousa
    posted to joao molmap by jxl on 2007-07-17 09:21:32 as ** along with 1 person and 1 group ucbcjbm EC
  • notes A Novel Logic-Based Approach for Quantitative Toxicology Prediction
    J. Chem. Inf. Model., Vol. 47, No. 3. (29 May 2007), pp. 998-1006.
    by A Amini, SH Muggleton, H Lodhi, MJE Sternberg
    posted to chemoinformatics mutcar by jxl on 2007-07-09 11:51:54 as ** along with 1 group EC
  • A systematic approach to simulating metabolism in computational toxicology. I. The TIMES heuristic modelling framework.
    Curr Pharm Des, Vol. 10, No. 11. (2004), pp. 1273-1293.
    by OG Mekenyan, SD Dimitrov, TS Pavlov, GD Veith
    posted to metabolism mutcar by jxl on 2007-06-26 11:46:23 as ** along with 1 group EC
  • Identification of the Structural Requirements for Mutagencitiy, by Incorporating Molecular Flexibility and Metabolic Activation of Chemicals. II. General Ames Mutagenicity Model
    Chem. Res. Toxicol., Vol. 20, No. 4. (16 April 2007), pp. 662-676.
    by R Serafimova, M Todorov, T Pavlov, S Kotov, E Jacob, A Aptula, O Mekenyan
    posted to metabolism mutcar by jxl on 2007-06-26 11:23:42 as ** along with 1 group EC
  • International Science Forum on Computational Toxicology
    (21-23 May 2007)
    by Jin
    posted to computational toxicology by jxl on 2007-06-23 12:49:32 as ** along with 1 group EC
  • Chemoinformatics: past, present, and future.
    J Chem Inf Model, Vol. 46, No. 6. (c 2006), pp. 2230-2255.
    by WL Chen
    posted to chemoinformatics review by jxl on 2007-06-15 14:24:09 as ** along with 1 group EC
  • Basic overview of chemoinformatics.
    J Chem Inf Model, Vol. 46, No. 6. (c 2006), pp. 2267-2277.
    by T Engel
    posted to chemoinformatics review by jxl on 2007-06-15 14:22:46 as ** along with 3 people and 1 group Borelli alexg tullachBui EC
  • Recent Advances in Chemoinformatics.
    J Chem Inf Model (19 May 2007)
    by Dimitris K Agrafiotis, Deepak Bandyopadhyay, Jörg K Wegner, Herman V Vlijmen
    posted to chemoinformatics by jxl on 2007-06-15 14:18:52 as ** along with 3 people and 4 groups joergkurtwegner daevans LamBras EC Molecular-Modelling Drug-Design Cheminformatics
  • Chemical structure indexing of toxicity data on the internet: moving toward a flat world.
    Curr Opin Drug Discov Devel, Vol. 9, No. 3. (May 2006), pp. 314-325.
    by AM Richard, LS Gold, MC Nicklaus
    posted to chemoinformatics predictive toxicology by jxl on 2007-06-15 14:13:21 as ** along with 1 group EC
  • The Expanding Role of Predictive Toxicology: An Update on the (Q)SAR Models for Mutagens and Carcinogens.
    J Environ Sci Health C Environ Carcinog Ecotoxicol Rev, Vol. 25, No. 1. (January 2007), pp. 53-97.
    by R Benigni, TI Netzeva, E Benfenati, C Bossa, R Franke, C Helma, E Hulzebos, C Marchant, A Richard, YT Woo, C Yang
    posted to chemistry mutcar predictive by jxl on 2007-06-15 14:11:09 as ***** along with 1 person and 1 group foleyfresh EC
  • notes Navigating chemical space for biology and medicine
    Nature, Vol. 432, No. 7019. (16 December 2004), pp. 855-861.
    by Christopher Lipinski, Andrew Hopkins
    posted to drug_discovery by jxl on 2007-06-12 21:33:57 as ** along with 5 people and 4 groups BragilMassoud kuhn marcius caporaso blackbart EC biomedical-nlp BioinfoCIPF SGU-CIPF
  • Practical feature subset selection for Machine Learning
    (1996)
    by M Hall, L Smith
    posted to featureselection machinelearning by jxl on 2007-06-07 11:34:03 as ** along with 1 group EC
  • notes Strategy for genotoxicity testing--metabolic considerations.
    Mutat Res, Vol. 627, No. 1. (3 February 2007), pp. 59-77.
    by WW Ku, A Bigger, G Brambilla, H Glatt, E Gocke, PJ Guzzie, A Hakura, M Honma, HJ Martus, RS Obach, S Roberts,
    posted to metabolism mutcar by jxl on 2007-06-07 10:44:40 as ** along with 1 group EC
  • A Comparative Study of Machine Learning Algorithms Applied to Predictive Toxicology Data Mining
    Alternative Laboratory Animals, No. 35. (2007), pp. 25-32.
    by Daniel C Neagu, Gongde Guo, Paul R Trundle, Mark TD Cronin2
    posted to chemoinformatics ml mutcar by jxl on 2007-06-07 10:34:10 as ** along with 1 group EC
  • Computational Prediction of the Chromosome-Damaging Potential of Chemicals
    by Andreas Rothfuss, Thomas S Hartmann, Nikolaus Heinrich, Jörg Wichard
    posted to mutcar by jxl on 2007-06-05 12:47:30 as ** along with 1 group EC
  • notes Future of Toxicology-Metabolic Activation and Drug Design: Challenges and Opportunities in Chemical Toxicology
    Chem. Res. Toxicol., Vol. 19, No. 7. (17 July 2006), pp. 889-893.
    by TA Baillie
    posted to metabolism mutcar by jxl on 2007-06-05 12:28:08 as ** along with 1 group EC
  • ADMET in silico modelling: towards prediction paradise?
    Nat Rev Drug Discov, Vol. 2, No. 3. (March 2003), pp. 192-204.
    by H van de Waterbeemd, E Gifford
    posted to chemoinformatics by jxl on 2007-05-29 16:14:59 as ** along with 1 person and 2 groups paolo Bioinformatics EC
  • notes SLIPPER-2001 - Software for Predicting Molecular Properties on the Basis of Physicochemical Descriptors and Structural Similarity
    J. Chem. Inf. Model., Vol. 42, No. 3. (28 May 2002), pp. 540-549.
    by OA Raevsky, SV Trepalin, HP Trepalina, VA Gerasimenko, OE Raevskaja
    posted to chemoinformatics by jxl on 2007-05-29 16:03:03 as ** along with 1 group EC
  • notes History of the enzyme nomenclature system
    Bioinformatics, Vol. 16, No. 1. (1 January 2000), pp. 34-40.
    by Keith Tipton, Sinead Boyce
    posted to metabolism by jxl on 2007-05-14 10:44:38 as ** along with 2 people and 1 group tny robert EC
  • notes Prediction of protein solvent accessibility using fuzzy <it>k</it>-nearest neighbor method
    Bioinformatics, Vol. 21, No. 12. (15 June 2005), pp. 2844-2849.
    by Jaehyun Sim, Seung-Yeon Kim, Julian Lee
    posted to fuzzy by jxl on 2007-05-14 09:40:28 as ** along with 1 person and 1 group newton1234 EC
  • Interactive exploration of fuzzy clusters using Neighborgrams
    Fuzzy Sets and Systems, Vol. 149 (2005), pp. 21-37.
    by Michael R Berthold, B Wiswedel, DE Patterson
    posted to fuzzy by jxl on 2007-04-30 09:50:31 as ** along with 1 group EC
  • notes The random subspace method for constructing decision forests
    Pattern Analysis and Machine Intelligence, IEEE Transactions on, Vol. 20, No. 8. (1998), pp. 832-844.
    by Tin K Ho
    posted to ensemble by jxl on 2007-04-13 10:55:45 as ** along with 1 person and 1 group drivard EC
  • notes Ensembling local learners ThroughMultimodal perturbation
    Systems, Man and Cybernetics, Part B, IEEE Transactions on, Vol. 35, No. 4. (2005), pp. 725-735.
    by Zhi-Hua Zhou, Yang Yu
    posted to ensemble by jxl on 2007-04-13 10:50:02 as ** along with 1 group EC
  • QSAR - How Good Is It in Practice? Comparison of Descriptor Sets on an Unbiased Cross Section of Corporate Data Sets
    J. Chem. Inf. Model., Vol. 46, No. 5. (2006), pp. 1924-1936.
    by Peter Gedeck, Bernhard Rohde, Christian Bartels
    posted to cheminformatics by jxl on 2007-01-25 16:06:37 as ** along with 1 group EC
  • Comparison of the computer programs DEREK and TOPKAT to predict bacterial mutagenicity
    Mutagenesis, Vol. 17, No. 4. (1 July 2002), pp. 321-329.
    by Neal F Cariello, John D Wilson, Ben H Britt, David J Wedd, Brian Burlinson, Vijay Gombar
    posted to chemoinformatics by jxl on 2006-12-18 16:32:51 as ** along with 1 group EC
  • notes Future of Toxicology-Predictive Toxicology: An Expanded View of "Chemical Toxicity"
    Chem. Res. Toxicol., Vol. 19, No. 10. (16 October 2006), pp. 1257-1262.
    by AM Richard
    posted to chemoinformatics by jxl on 2006-12-12 16:52:03 as ** along with 1 group EC
  • Linking data to models: data regression
    Nature Reviews Molecular Cell Biology, Vol. 7, No. 11. (27 September 2006), pp. 813-819.
    by Khuloud Jaqaman, Gaudenz Danuser
    posted to biology systems by jxl on 2006-12-07 15:17:39 as ** along with 5 people and 3 groups shikin nickluscombe glyg rahulthadani cdpwebadmin GeneGo EC EBI-regulation
  • notes Multiobjective Optimization in Quantitative Structure-Activity Relationships: Deriving Accurate and Interpretable QSARs
    J. Med. Chem., Vol. 45, No. 23. (7 November 2002), pp. 5069-5080.
    by O Nicolotti, VJ Gillet, PJ Fleming, DVS Green
    posted to chemoinformatics by jxl on 2006-11-30 11:09:33 as ** along with 1 group EC
  • notes A Review of: Predictive Toxicology
    International Journal of Toxicology, Vol. 25, No. 5. (October 2006), pp. 429-431.
    by Greene, Nigel
    posted to chemoinformatics by jxl on 2006-11-28 17:00:01 as ** along with 1 group EC
  • The Distinction between Genotoxic and Epigenetic Carcinogens and Implication for Cancer Risk
    Toxicol. Sci., Vol. 57, No. 1. (1 September 2000), pp. 4-5.
    by John H Weisburger, Gary M Williams
    posted to mutcar by jxl on 2006-11-28 16:55:40 as ** along with 1 group EC
  • notes Artificial Intelligence and Data Mining for Toxicity Prediction
    Current Computer - Aided Drug Design, Vol. 2, No. 2. (June 2006), pp. 123-133.
    by Helma, Christoph, Kazius, Jeroen
    posted to cheminformatics by jxl on 2006-09-06 16:28:24 as ***** along with 1 group EC
  • notes The Art of Data Mining the Minefields of Toxicity Databases to Link Chemistry to Biology
    Current Computer - Aided Drug Design, Vol. 2, No. 2. (June 2006), pp. 135-150.
    by Yang, Chihae, Richard, M Ann, Cross, P Kevin
    posted to cheminformatics by jxl on 2006-09-06 16:24:14 as ***** along with 1 group EC
  • notes Data mining Tutorial (SQL server 2005)
    by Seth Paul, Jamie Maclennan, Zhaohui Tang, Scott Oveson
    posted to sqlserverdatamining by jxl on 2006-08-22 23:49:35 as ** along with 1 group EC
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