메뉴 건너뛰기




Volumn 137, Issue , 2014, Pages 82-90

QSAR classification model for diverse series of antimicrobial agents using classification tree configured by modified particle swarm optimization

Author keywords

Antimicrobial agents; Candida albicans; Classification tree; Classification tree configured by modified particle swarm optimization; Particle swarm optimization; QSAR

Indexed keywords

ANTIINFECTIVE AGENT;

EID: 84904108152     PISSN: 01697439     EISSN: 18733239     Source Type: Journal    
DOI: 10.1016/j.chemolab.2014.06.011     Document Type: Article
Times cited : (20)

References (26)
  • 1
    • 0034329375 scopus 로고    scopus 로고
    • Membrane transporters and antifungal drug resistance
    • Georgiev V.S. Membrane transporters and antifungal drug resistance. Curr. Drug Targets 2000, 1:261-284.
    • (2000) Curr. Drug Targets , vol.1 , pp. 261-284
    • Georgiev, V.S.1
  • 2
    • 0032173607 scopus 로고    scopus 로고
    • Antifungals: mechanism of action and resistance, established and novel drugs
    • Georgopapadakou N.H. Antifungals: mechanism of action and resistance, established and novel drugs. Curr. Opin. Microbiol. 1998, 1:547-557.
    • (1998) Curr. Opin. Microbiol. , vol.1 , pp. 547-557
    • Georgopapadakou, N.H.1
  • 3
    • 0028922813 scopus 로고
    • Fungemia in children infected with the human immunodeficiency virus: new epidemiologic patterns, emerging pathogens, and improved outcome with antifungal therapy
    • Walsh T.J., Gonzalez C., Roilides E., Mueller B.U., Ali N., Lewis L.L., Whitcomb T.O., Marshall D.J., Pizzo P.A. Fungemia in children infected with the human immunodeficiency virus: new epidemiologic patterns, emerging pathogens, and improved outcome with antifungal therapy. Clin. Infect. Dis. 1995, 20:900-906.
    • (1995) Clin. Infect. Dis. , vol.20 , pp. 900-906
    • Walsh, T.J.1    Gonzalez, C.2    Roilides, E.3    Mueller, B.U.4    Ali, N.5    Lewis, L.L.6    Whitcomb, T.O.7    Marshall, D.J.8    Pizzo, P.A.9
  • 4
    • 33746913105 scopus 로고    scopus 로고
    • Synthesis and antifungal activity of a novel series of alkyldimethylamine cyanoboranes and their derivatives
    • Takrouri K., Oren G., Polacheck I., Sionov E., Shalom E., Katzhendler J., Srebnik M. Synthesis and antifungal activity of a novel series of alkyldimethylamine cyanoboranes and their derivatives. J. Med. Chem. 2006, 49:4879-4885.
    • (2006) J. Med. Chem. , vol.49 , pp. 4879-4885
    • Takrouri, K.1    Oren, G.2    Polacheck, I.3    Sionov, E.4    Shalom, E.5    Katzhendler, J.6    Srebnik, M.7
  • 6
    • 7444249091 scopus 로고    scopus 로고
    • Carboxylic acid and phosphate ester derivatives of fluconazole: synthesis and antifungal activities
    • Nam N., Sardari S., Selecky M., Parang K. Carboxylic acid and phosphate ester derivatives of fluconazole: synthesis and antifungal activities. Bioorg. Med. Chem. 2004, 12:6255-6269.
    • (2004) Bioorg. Med. Chem. , vol.12 , pp. 6255-6269
    • Nam, N.1    Sardari, S.2    Selecky, M.3    Parang, K.4
  • 7
    • 34548847476 scopus 로고    scopus 로고
    • Quantitative structure-activity relationship studies for prediction of antimicrobial activity of synthesized 2,4-hexadienoic acid derivatives
    • Narasimhan B., Judge V., Narang R., Ohlan R., Ohlan S. Quantitative structure-activity relationship studies for prediction of antimicrobial activity of synthesized 2,4-hexadienoic acid derivatives. Bioorg. Med. Chem. Lett. 2007, 17:5836-5845.
    • (2007) Bioorg. Med. Chem. Lett. , vol.17 , pp. 5836-5845
    • Narasimhan, B.1    Judge, V.2    Narang, R.3    Ohlan, R.4    Ohlan, S.5
  • 8
    • 0033816579 scopus 로고    scopus 로고
    • Understanding the antifungal activity of terbinafine analogues using quantitative structure-activity relationship (QSAR) models
    • Gokhale V.M., Kulkarni V.M. Understanding the antifungal activity of terbinafine analogues using quantitative structure-activity relationship (QSAR) models. Bioorg. Med. Chem. 2000, 8:2487-2499.
    • (2000) Bioorg. Med. Chem. , vol.8 , pp. 2487-2499
    • Gokhale, V.M.1    Kulkarni, V.M.2
  • 9
    • 60549084724 scopus 로고    scopus 로고
    • Synthesis and QSAR evaluation of 2-(substitutedphenyl)-1H benzimidazoles and [2-(substituted phenyl)-benzimidazol-1-yl]-pyridin-3-yl-methanones
    • Sharma D., Narasimhan B., Kumar P., Jalbout A. Synthesis and QSAR evaluation of 2-(substitutedphenyl)-1H benzimidazoles and [2-(substituted phenyl)-benzimidazol-1-yl]-pyridin-3-yl-methanones. Eur. J. Med. Chem. 2009, 44:1119-1127.
    • (2009) Eur. J. Med. Chem. , vol.44 , pp. 1119-1127
    • Sharma, D.1    Narasimhan, B.2    Kumar, P.3    Jalbout, A.4
  • 10
    • 84893190673 scopus 로고    scopus 로고
    • Synthesis and biological evaluation of thiazoline derivatives as new antimicrobial and anticancer agents
    • Altintop M.D., Kaplanciki Z.A., Ciftci G.A., Demirel R. Synthesis and biological evaluation of thiazoline derivatives as new antimicrobial and anticancer agents. Eur. J. Med. Chem. 2014, 74:264-277.
    • (2014) Eur. J. Med. Chem. , vol.74 , pp. 264-277
    • Altintop, M.D.1    Kaplanciki, Z.A.2    Ciftci, G.A.3    Demirel, R.4
  • 11
    • 47349120200 scopus 로고    scopus 로고
    • Mati, QSAR modeling of the antifungal activity against Candida albicans for a diverse set of organic compounds
    • Katritzky A.R., Slavov H.S., Svetoslav D.A., Dobchev K. Mati, QSAR modeling of the antifungal activity against Candida albicans for a diverse set of organic compounds. Bioorg. Med. Chem. 2008, 16:7055-7069.
    • (2008) Bioorg. Med. Chem. , vol.16 , pp. 7055-7069
    • Katritzky, A.R.1    Slavov, H.S.2    Svetoslav, D.A.3    Dobchev, K.4
  • 12
    • 77955926475 scopus 로고    scopus 로고
    • QSAR studies of a diverse series of antimicrobial agents against Candida albicans by classification and regression trees
    • Tan S.M., Jiao J., Zhu X.L., Zhou Y.P., Song D.D., Gong H., Yu R.Q. QSAR studies of a diverse series of antimicrobial agents against Candida albicans by classification and regression trees. Chemometr. Intell. Lab. Syst. 2010, 103:184-190.
    • (2010) Chemometr. Intell. Lab. Syst. , vol.103 , pp. 184-190
    • Tan, S.M.1    Jiao, J.2    Zhu, X.L.3    Zhou, Y.P.4    Song, D.D.5    Gong, H.6    Yu, R.Q.7
  • 13
    • 84861856722 scopus 로고    scopus 로고
    • Synthesis, antimicrobial evaluation, and QSAR analysis of 2-isopropyl-5- methylcyclohexanol derivatives
    • Singh M., Kumar S., Kumar A., Kumar P., Narasimhan B. Synthesis, antimicrobial evaluation, and QSAR analysis of 2-isopropyl-5- methylcyclohexanol derivatives. Med. Chem. Res. 2012, 21:511-522.
    • (2012) Med. Chem. Res. , vol.21 , pp. 511-522
    • Singh, M.1    Kumar, S.2    Kumar, A.3    Kumar, P.4    Narasimhan, B.5
  • 14
    • 4644257234 scopus 로고    scopus 로고
    • Esters, amides and substituted derivatives of cinnamic acid: synthesis, antimicrobial activity and QSAR investigations
    • Narasimhan B., Belsare D., Pharande D., Mourya V., Dhake A. Esters, amides and substituted derivatives of cinnamic acid: synthesis, antimicrobial activity and QSAR investigations. Eur. J. Med. Chem. 2004, 39:827-834.
    • (2004) Eur. J. Med. Chem. , vol.39 , pp. 827-834
    • Narasimhan, B.1    Belsare, D.2    Pharande, D.3    Mourya, V.4    Dhake, A.5
  • 15
    • 84904111487 scopus 로고    scopus 로고
    • QSAR in ecotoxicity: an overview of modern classification techniques
    • Mazzatorta P., Benfenati E., Lorenzini P., Vighi M. QSAR in ecotoxicity: an overview of modern classification techniques. J. Chem. Inf. Model. 2010, 44:1053-1062.
    • (2010) J. Chem. Inf. Model. , vol.44 , pp. 1053-1062
    • Mazzatorta, P.1    Benfenati, E.2    Lorenzini, P.3    Vighi, M.4
  • 16
    • 77954075802 scopus 로고    scopus 로고
    • Gaussian processes for classification: QSAR modeling of ADMET and target activity
    • Obrezanova O., Matthew D.S. Gaussian processes for classification: QSAR modeling of ADMET and target activity. J. Chem. Inf. Model. 2010, 50:1053-1061.
    • (2010) J. Chem. Inf. Model. , vol.50 , pp. 1053-1061
    • Obrezanova, O.1    Matthew, D.S.2
  • 18
    • 84866647773 scopus 로고    scopus 로고
    • GA(M)E-QSAR: a novel, fully automatic genetic-algorithm-(meta)- ensembles approach for binary classification in ligand-based drug design
    • Perez-Castillo Y., Lazar C., Taminau J., Froeyen M., Cabrera-Perez M.A., Nowe A. GA(M)E-QSAR: a novel, fully automatic genetic-algorithm-(meta)- ensembles approach for binary classification in ligand-based drug design. J. Chem. Inf. Model. 2012, 52:2366-2386.
    • (2012) J. Chem. Inf. Model. , vol.52 , pp. 2366-2386
    • Perez-Castillo, Y.1    Lazar, C.2    Taminau, J.3    Froeyen, M.4    Cabrera-Perez, M.A.5    Nowe, A.6
  • 19
    • 66249116650 scopus 로고    scopus 로고
    • Modified particle swarm optimization algorithm for adaptively configuring globally optimal classification and regression trees
    • Zhou Y.P., Tang L.J., Jiao J., Song D.D., Jiang J.H., Yu R.Q. Modified particle swarm optimization algorithm for adaptively configuring globally optimal classification and regression trees. J. Chem. Inf. Model. 2009, 49:1144-1153.
    • (2009) J. Chem. Inf. Model. , vol.49 , pp. 1144-1153
    • Zhou, Y.P.1    Tang, L.J.2    Jiao, J.3    Song, D.D.4    Jiang, J.H.5    Yu, R.Q.6
  • 21
    • 33646023117 scopus 로고    scopus 로고
    • An introduction to ROC analysis
    • Fawcett T. An introduction to ROC analysis. Pattern Recogn. Lett. 2006, 27:861-874.
    • (2006) Pattern Recogn. Lett. , vol.27 , pp. 861-874
    • Fawcett, T.1
  • 23
    • 84886259081 scopus 로고    scopus 로고
    • Radial basis function network-based transformation for nonlinear partial least-squares as optimized by particle swarm optimization: application to QSAR studies
    • Xing J.J., Luo R.M., Guo H.L., Li Y.Q., Fu H.Y., Yang T.M., Zhou Y.P. Radial basis function network-based transformation for nonlinear partial least-squares as optimized by particle swarm optimization: application to QSAR studies. Chemometr. Intell. Lab. Syst. 2014, 130:37-44.
    • (2014) Chemometr. Intell. Lab. Syst. , vol.130 , pp. 37-44
    • Xing, J.J.1    Luo, R.M.2    Guo, H.L.3    Li, Y.Q.4    Fu, H.Y.5    Yang, T.M.6    Zhou, Y.P.7
  • 24
    • 5444267543 scopus 로고    scopus 로고
    • Hybridized particle swarm algorithm for adaptive structure training of multilayer feed-forward neural network: QSAR studies of bioactivity of organic compounds
    • Shen Q., Jiang J.H., Jiao C.X., Lin W.Q., Shen G.L., Yu R.Q. Hybridized particle swarm algorithm for adaptive structure training of multilayer feed-forward neural network: QSAR studies of bioactivity of organic compounds. J. Comput. Chem. 2004, 25:1726-1735.
    • (2004) J. Comput. Chem. , vol.25 , pp. 1726-1735
    • Shen, Q.1    Jiang, J.H.2    Jiao, C.X.3    Lin, W.Q.4    Shen, G.L.5    Yu, R.Q.6
  • 25
    • 0031753758 scopus 로고    scopus 로고
    • Detection of nonlinearity in multivariate calibration
    • Centner V., de Noord O.E., Massart D.L. Detection of nonlinearity in multivariate calibration. Anal. Chim. Acta. 1998, 376:153-168.
    • (1998) Anal. Chim. Acta. , vol.376 , pp. 153-168
    • Centner, V.1    de Noord, O.E.2    Massart, D.L.3


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.