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Volumn 57, Issue 5, 2017, Pages 1013-1017

Pred-Skin: A Fast and Reliable Web Application to Assess Skin Sensitization Effect of Chemicals

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTATIONAL CHEMISTRY; DIAGNOSIS; MOLECULAR GRAPHICS; PORTALS;

EID: 85020478864     PISSN: 15499596     EISSN: 1549960X     Source Type: Journal    
DOI: 10.1021/acs.jcim.7b00194     Document Type: Article
Times cited : (66)

References (30)
  • 1
    • 84892364605 scopus 로고    scopus 로고
    • Occupational and Non-Occupational Allergic Contact Dermatitis: A Follow-up Study
    • Macan, J.; Rimac, D.; Kežić, S.; Varnai, V. M. Occupational and Non-Occupational Allergic Contact Dermatitis: A Follow-up Study Dermatology 2013, 227, 321-329 10.1159/000354763
    • (2013) Dermatology , vol.227 , pp. 321-329
    • Macan, J.1    Rimac, D.2    Kežić, S.3    Varnai, V.M.4
  • 3
    • 77249164989 scopus 로고    scopus 로고
    • European Union. No. L 136
    • European Union. Regulation (EC) No 1907/2006; 2007; No. L 136, pp 3-280.
    • (2007) Regulation (EC) No 1907/2006 , pp. 3-280
  • 6
    • 85020431666 scopus 로고    scopus 로고
    • European Commission. On the animal testing and marketingban and on the state of play in relation to alternative methods inthe field of cosmetics. (accessed Feb 9)
    • European Commission. On the animal testing and marketingban and on the state of play in relation to alternative methods inthe field of cosmetics. http://ec.europa.eu/consumers/sectors/cosmetics/files/pdf/animal-testing/com-at-2013-en.pdf (accessed Feb 9, 2016).
    • (2016)
  • 8
    • 84904051395 scopus 로고    scopus 로고
    • Towards AOP Application - Implementation of an Integrated Approach to Testing and Assessment (IATA) into a Pipeline Tool for Skin Sensitization
    • Patlewicz, G.; Kuseva, C.; Kesova, A.; Popova, I.; Zhechev, T.; Pavlov, T.; Roberts, D. W.; Mekenyan, O. Towards AOP Application-Implementation of an Integrated Approach to Testing and Assessment (IATA) into a Pipeline Tool for Skin Sensitization Regul. Toxicol. Pharmacol. 2014, 69, 529-545 10.1016/j.yrtph.2014.06.001
    • (2014) Regul. Toxicol. Pharmacol. , vol.69 , pp. 529-545
    • Patlewicz, G.1    Kuseva, C.2    Kesova, A.3    Popova, I.4    Zhechev, T.5    Pavlov, T.6    Roberts, D.W.7    Mekenyan, O.8
  • 10
    • 84948704233 scopus 로고    scopus 로고
    • Computational Toxicology: Its Essential Role in Reducing Drug Attrition
    • Naven, R.; Louise-May, S. Computational Toxicology: Its Essential Role in Reducing Drug Attrition Hum. Exp. Toxicol. 2015, 34, 1304-1309 10.1177/0960327115605440
    • (2015) Hum. Exp. Toxicol. , vol.34 , pp. 1304-1309
    • Naven, R.1    Louise-May, S.2
  • 11
    • 85020440305 scopus 로고    scopus 로고
    • OECD. QSAR Toolbox v. 3.2. (accessed Oct 6)
    • OECD. QSAR Toolbox v. 3.2. http://www.qsartoolbox.org/ (accessed Oct 6, 2014).
    • (2014)
  • 12
    • 84865485155 scopus 로고    scopus 로고
    • ToxAlerts: A Web Server of Structural Alerts for Toxic Chemicals and Compounds with Potential Adverse Reactions
    • Sushko, I.; Salmina, E.; Potemkin, V. a; Poda, G.; Tetko, I. V. ToxAlerts: A Web Server of Structural Alerts for Toxic Chemicals and Compounds with Potential Adverse Reactions J. Chem. Inf. Model. 2012, 52, 2310-2316 10.1021/ci300245q
    • (2012) J. Chem. Inf. Model. , vol.52 , pp. 2310-2316
    • Sushko, I.1    Salmina, E.2    Potemkin, V.A.3    Poda, G.4    Tetko, I.V.5
  • 14
    • 84929366158 scopus 로고    scopus 로고
    • Predicting Chemically-Induced Skin Reactions. Part I: QSAR Models of Skin Sensitization and Their Application to Identify Potentially Hazardous Compounds
    • Alves, V. M.; Muratov, E. N.; Fourches, D.; Strickland, J.; Kleinstreuer, N.; Andrade, C. H.; Tropsha, A. Predicting Chemically-Induced Skin Reactions. Part I: QSAR Models of Skin Sensitization and Their Application to Identify Potentially Hazardous Compounds Toxicol. Appl. Pharmacol. 2015, 284, 262-272 10.1016/j.taap.2014.12.014
    • (2015) Toxicol. Appl. Pharmacol. , vol.284 , pp. 262-272
    • Alves, V.M.1    Muratov, E.N.2    Fourches, D.3    Strickland, J.4    Kleinstreuer, N.5    Andrade, C.H.6    Tropsha, A.7
  • 18
    • 78049349961 scopus 로고    scopus 로고
    • Trust, but Verify: On the Importance of Chemical Structure Curation in Cheminformatics and QSAR Modeling Research
    • Fourches, D.; Muratov, E.; Tropsha, A. Trust, but Verify: On the Importance of Chemical Structure Curation in Cheminformatics and QSAR Modeling Research J. Chem. Inf. Model. 2010, 50, 1189-1204 10.1021/ci100176x
    • (2010) J. Chem. Inf. Model. , vol.50 , pp. 1189-1204
    • Fourches, D.1    Muratov, E.2    Tropsha, A.3
  • 20
    • 84979530276 scopus 로고    scopus 로고
    • Trust, but Verify II: A Practical Guide to Chemogenomics Data Curation
    • Fourches, D.; Muratov, E.; Tropsha, A. Trust, but Verify II: A Practical Guide to Chemogenomics Data Curation J. Chem. Inf. Model. 2016, 56, 1243-1252 10.1021/acs.jcim.6b00129
    • (2016) J. Chem. Inf. Model. , vol.56 , pp. 1243-1252
    • Fourches, D.1    Muratov, E.2    Tropsha, A.3
  • 21
    • 44249116058 scopus 로고    scopus 로고
    • Hierarchical QSAR Technology Based on the Simplex Representation of Molecular Structure
    • Kuz'min, V. E.; Artemenko, A. G.; Muratov, E. N. Hierarchical QSAR Technology Based on the Simplex Representation of Molecular Structure J. Comput.-Aided Mol. Des. 2008, 22, 403-421 10.1007/s10822-008-9179-6
    • (2008) J. Comput.-Aided Mol. Des. , vol.22 , pp. 403-421
    • Kuz'Min, V.E.1    Artemenko, A.G.2    Muratov, E.N.3
  • 22
    • 77956964002 scopus 로고    scopus 로고
    • Best Practices for QSAR Model Development, Validation, and Exploitation
    • Tropsha, A. Best Practices for QSAR Model Development, Validation, and Exploitation Mol. Inf. 2010, 29, 476-488 10.1002/minf.201000061
    • (2010) Mol. Inf. , vol.29 , pp. 476-488
    • Tropsha, A.1
  • 23
    • 0035478854 scopus 로고    scopus 로고
    • Random Forests
    • Breiman, L. E. O. Random Forests Mach. Learn. 2001, 45, 5-32 10.1023/A:1010933404324
    • (2001) Mach. Learn. , vol.45 , pp. 5-32
    • Breiman, L.E.O.1
  • 27
    • 84879938724 scopus 로고    scopus 로고
    • JSME: A Free Molecule Editor in JavaScript
    • Bienfait, B.; Ertl, P. JSME: A Free Molecule Editor in JavaScript J. Cheminf. 2013, 5, 24 10.1186/1758-2946-5-24
    • (2013) J. Cheminf. , vol.5 , pp. 24
    • Bienfait, B.1    Ertl, P.2
  • 29
    • 84887125467 scopus 로고    scopus 로고
    • Similarity Maps - A Visualization Strategy for Molecular Fingerprints and Machine-Learning Methods
    • Riniker, S.; Landrum, G. a. Similarity Maps-A Visualization Strategy for Molecular Fingerprints and Machine-Learning Methods J. Cheminf. 2013, 5, 43 10.1186/1758-2946-5-43
    • (2013) J. Cheminf. , vol.5 , pp. 43
    • Riniker, S.1    Landrum, G.A.2
  • 30
    • 84946039344 scopus 로고    scopus 로고
    • Correlation between Experimental Human and Murine Skin Sensitization Induction Thresholds
    • Api, A. M.; Basketter, D.; Lalko, J. Correlation between Experimental Human and Murine Skin Sensitization Induction Thresholds Cutaneous Ocul. Toxicol. 2015, 34, 298 10.3109/15569527.2014.979425
    • (2015) Cutaneous Ocul. Toxicol. , vol.34 , pp. 298
    • Api, A.M.1    Basketter, D.2    Lalko, J.3


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.