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Volumn 26, Issue 2, 2001, Pages 241-254

ANN modeling of the penetration across a polydimethylsiloxane membrane from theoretically derived molecular descriptors

Author keywords

ANNs; GNNs; Molecular descriptors; Polydimethylsiloxane membrane; QSAR

Indexed keywords

2 FUROIC ACID; 2 NAPHTHOL; 4 NITROBENZOIC ACID; ACRIDINE; ANILINE; ANTHRACENE; BENZAMIDE; BENZENE; BENZIMIDAZOLE; BENZOHYDROXAMIC ACID; BENZONITRILE; BIPHENYL; CARBANILAMIDE; CHLOROBENZENE; DIMETICONE; DRUG; FURFURYL ALCOHOL; IMIDAZOLE; INDOLE; IODOBENZENE; ISOPHTHALIC ACID; METHYL PARABEN; PICOLINIC ACID; PYRAZOLE; PYRIDINE; PYRROLE; QUINOLINE; STYRENE; TOLUENE; UNINDEXED DRUG;

EID: 0034904843     PISSN: 07317085     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0731-7085(01)00421-6     Document Type: Article
Times cited : (32)

References (37)
  • 2
    • 0023103368 scopus 로고
    • Transdermal drug delivery and cutaneous metabolism
    • (1987) Xenobiotica , vol.17 , pp. 325-343
    • Guy, R.H.1
  • 10
    • 0029618807 scopus 로고
    • A predictive algorithm for skin permeability: The effects of molecular size and hydrogen bond activity
    • (1995) Pharm. Res. , vol.12 , pp. 1628-1633
    • Potts, R.O.1    Guy, R.H.2
  • 11
    • 0028957314 scopus 로고
    • QSAR analysis of skin permeability of various drugs in man as compared to in vivo and in vitro studies in rodents
    • (1995) Pharm. Res. , vol.12 , pp. 583-587
    • Lien, E.J.1    Gao, H.2
  • 12
    • 0033995212 scopus 로고    scopus 로고
    • Epidermal permeability-penetrant structure relationships: 4, QSAR of permeant diffusion across human stratum corneum in terms of molecular weight, H-bonding and electronic charge
    • (2000) Int. J. Pharm. , vol.197 , pp. 203-211
    • Pugh, W.J.1    Degim, I.T.2    Hadgraft, J.3
  • 20
    • 0026738394 scopus 로고
    • Application of neural networks: Quantitative structure-activity relationships of the derivatives of 2,4-diamino-5- (sub stituted-benzyl)pyrimidines as DHFR inhibitors
    • (1992) J. Med. Chem. , vol.35 , pp. 3201-3207
    • So, S.1    Richards, W.G.2
  • 23
    • 0027667984 scopus 로고
    • Evaluation of neural networks based on radial basis functions and their application to the prediction of boiling points from structural parameters
    • (1993) J. Chem. Inf. Comput. Sci. , vol.3 , pp. 736-744
    • Lohninger, H.1
  • 28
    • 0000805679 scopus 로고
    • The molecular connectivity χ indices and κ shape indices in structure-property modeling
    • D.B. Boyd, K. Lipkowitz (Eds.), Indiana University-Purdue University at Indianapolis (IUPU)
    • (1991) Reviews of Computational Chemistry , vol.2 , pp. 367-422
    • Hall, L.H.1    Kier, L.B.2
  • 33
    • 0000136320 scopus 로고    scopus 로고
    • Reduced HOMO-LUMO gap as an index of kinetic stability for polycyclic aromatic hydrocarbons
    • (1999) J. Phys. Chem. , vol.103 , pp. 7487-7495
    • Aihara, J.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.