316 related articles for article (PubMed ID: 12062670)
1. Molecular descriptors that influence the amount of drugs transfer into human breast milk.
Agatonovic-Kustrin S; Ling LH; Tham SY; Alany RG
J Pharm Biomed Anal; 2002 Jun; 29(1-2):103-19. PubMed ID: 12062670
[TBL] [Abstract][Full Text] [Related]
2. QSAR: an in silico approach for predicting the partitioning of pesticides into breast milk.
Agatonovic-Kustrin S; Morton DW; Celebic D
Comb Chem High Throughput Screen; 2013 Mar; 16(3):223-32. PubMed ID: 23228029
[TBL] [Abstract][Full Text] [Related]
3. Theoretically-derived molecular descriptors important in human intestinal absorption.
Agatonovic-Kustrin S; Beresford R; Yusof AP
J Pharm Biomed Anal; 2001 May; 25(2):227-37. PubMed ID: 11275432
[TBL] [Abstract][Full Text] [Related]
4. ANN modeling of the penetration across a polydimethylsiloxane membrane from theoretically derived molecular descriptors.
Agatonovic-Kustrin S; Beresford R; Yusof AP
J Pharm Biomed Anal; 2001 Sep; 26(2):241-54. PubMed ID: 11470201
[TBL] [Abstract][Full Text] [Related]
5. QSAR treatment of drugs transfer into human breast milk.
Katritzky AR; Dobchev DA; Hür E; Fara DC; Karelson M
Bioorg Med Chem; 2005 Mar; 13(5):1623-32. PubMed ID: 15698780
[TBL] [Abstract][Full Text] [Related]
6. Prediction of corneal permeability using artificial neural networks.
Agatonovic-Kustrin S; Evans A; Alany RG
Pharmazie; 2003 Oct; 58(10):725-9. PubMed ID: 14609285
[TBL] [Abstract][Full Text] [Related]
7. Classification of drugs according to their milk/plasma concentration ratio.
Fatemi MH; Ghorbanzad'e M
Eur J Med Chem; 2010 Nov; 45(11):5051-5. PubMed ID: 20813438
[TBL] [Abstract][Full Text] [Related]
8. Quantitative structure-retention-pharmacokinetic relationship studies.
Agatonovic-Kustrin S; Turner JV; Glass BD
Drug Metab Lett; 2008 Apr; 2(2):130-7. PubMed ID: 19356082
[TBL] [Abstract][Full Text] [Related]
9. Prediction of human intestinal absorption of drug compounds from molecular structure.
Wessel MD; Jurs PC; Tolan JW; Muskal SM
J Chem Inf Comput Sci; 1998; 38(4):726-35. PubMed ID: 9691477
[TBL] [Abstract][Full Text] [Related]
10. Using general regression and probabilistic neural networks to predict human intestinal absorption with topological descriptors derived from two-dimensional chemical structures.
Niwa T
J Chem Inf Comput Sci; 2003; 43(1):113-9. PubMed ID: 12546543
[TBL] [Abstract][Full Text] [Related]
11. Prediction of milk/plasma drug concentration (M/P) ratio using support vector machine (SVM) method.
Zhao C; Zhang H; Zhang X; Zhang R; Luan F; Liu M; Hu Z; Fan B
Pharm Res; 2006 Jan; 23(1):41-8. PubMed ID: 16308669
[TBL] [Abstract][Full Text] [Related]
12. Comparison of statistical methods for predicting penetration capacity of drugs into human breast milk using physicochemical, pharmacokinetic and chromatographic descriptors.
Wanat K; Khakimov B; Brzezińska E
SAR QSAR Environ Res; 2020 Jun; 31(6):457-475. PubMed ID: 32627677
[TBL] [Abstract][Full Text] [Related]
13. Bioavailability prediction based on molecular structure for a diverse series of drugs.
Turner JV; Maddalena DJ; Agatonovic-Kustrin S
Pharm Res; 2004 Jan; 21(1):68-82. PubMed ID: 14984260
[TBL] [Abstract][Full Text] [Related]
14. Prediction of milk/plasma concentration ratio of drugs.
Larsen LA; Ito S; Koren G
Ann Pharmacother; 2003 Sep; 37(9):1299-306. PubMed ID: 12921514
[TBL] [Abstract][Full Text] [Related]
15. Application of the artificial neural network in quantitative structure-gradient elution retention relationship of phenylthiocarbamyl amino acids derivatives.
Tham SY; Agatonovic-Kustrin S
J Pharm Biomed Anal; 2002 May; 28(3-4):581-90. PubMed ID: 12008137
[TBL] [Abstract][Full Text] [Related]
16. Prediction of pK(a) for neutral and basic drugs based on radial basis function Neural networks and the heuristic method.
Luan F; Ma W; Zhang H; Zhang X; Liu M; Hu Z; Fan B
Pharm Res; 2005 Sep; 22(9):1454-60. PubMed ID: 16132357
[TBL] [Abstract][Full Text] [Related]
17. Chemical graphs, molecular matrices and topological indices in chemoinformatics and quantitative structure-activity relationships.
Ivanciuc O
Curr Comput Aided Drug Des; 2013 Jun; 9(2):153-63. PubMed ID: 23701000
[TBL] [Abstract][Full Text] [Related]
18. Artificial neural networks analysis used to evaluate the molecular interactions between selected drugs and human alpha1-acid glycoprotein.
Buciński A; Wnuk M; Goryński K; Giza A; Kochańczyk J; Nowaczyk A; Baczek T; Nasal A
J Pharm Biomed Anal; 2009 Nov; 50(4):591-6. PubMed ID: 19117712
[TBL] [Abstract][Full Text] [Related]
19. Prediction of polar surface area of drug molecules: a QSPR approach.
Noorizadeh H; Farmany A; Noorizadeh M; Kohzadi M
Drug Test Anal; 2013 Apr; 5(4):222-7. PubMed ID: 21539000
[TBL] [Abstract][Full Text] [Related]
20. QSAR of Chalcones Utilizing Theoretical Molecular Descriptors.
Nandi S; Bagchi MC
Curr Comput Aided Drug Des; 2015; 11(2):184-93. PubMed ID: 26135340
[TBL] [Abstract][Full Text] [Related]
[Next] [New Search]