181 related articles for article (PubMed ID: 12761606)
1. Prediction of n-octanol/water partition coefficients for polychlorinated dibenzo-p-dioxins using a general regression neural network.
Zheng G; Huang WH; Lu XH
Anal Bioanal Chem; 2003 Jul; 376(5):680-5. PubMed ID: 12761606
[TBL] [Abstract][Full Text] [Related]
2. Quantitative structure-property relationship studies on n-octanol/water partitioning coefficients of PCDD/Fs.
Chen J; Quan X; Yazhi Z; Yan Y; Yang F
Chemosphere; 2001 Sep; 44(6):1369-74. PubMed ID: 11513114
[TBL] [Abstract][Full Text] [Related]
3. QSPR modeling of n-octanol/air partition coefficients and liquid vapor pressures of polychlorinated dibenzo-p-dioxins.
Zeng XL; Zhang XL; Wang Y
Chemosphere; 2013 Apr; 91(2):229-32. PubMed ID: 23357862
[TBL] [Abstract][Full Text] [Related]
4. Predictability of physicochemical properties of polychlorinated dibenzo-p-dioxins (PCDDs) based on single-molecular descriptor models.
Kim M; Li LY; Grace JR
Environ Pollut; 2016 Jun; 213():99-111. PubMed ID: 26878604
[TBL] [Abstract][Full Text] [Related]
5. Single-descriptor based quantum-chemical QSPRs for physico-chemical properties of polychlorinated-dibenzo-p-dioxins and -dibenzo-furans (PCDD/Fs): exploring the role of electron-correlation.
Vikas ; Chayawan
Chemosphere; 2015 Jan; 118():239-45. PubMed ID: 25282689
[TBL] [Abstract][Full Text] [Related]
6. Application of TLSER method in predicting the aqueous solubility and n-octanol/water partition coefficient of PCBs, PCDDs and PCDFs.
Huang J; Yu G; Zhang ZL; Wang YL; Zhu WH; Wu GS
J Environ Sci (China); 2004; 16(1):21-9. PubMed ID: 14971446
[TBL] [Abstract][Full Text] [Related]
7. QSAR study on the Ah receptor-binding affinities of polyhalogenated dibenzo-p-dioxins using net atomic-charge descriptors and a radial basis neural network.
Zheng G; Xiao M; Lu XH
Anal Bioanal Chem; 2005 Nov; 383(5):810-6. PubMed ID: 16231135
[TBL] [Abstract][Full Text] [Related]
8. A neural network based prediction of octanol-water partition coefficients using atomic5 fragmental descriptors.
Molnár L; Keseru GM; Papp A; Gulyás Z; Darvas F
Bioorg Med Chem Lett; 2004 Feb; 14(4):851-3. PubMed ID: 15012980
[TBL] [Abstract][Full Text] [Related]
9. Mathematical relationships between vapor pressure, water solubility, Henry's law constant, n-octanol/water partition coefficent and gas chromatographic retention index of polychlorinated-dibenzo-dioxins.
Wan YH; Wong PK
Water Res; 2002 Jan; 36(1):350-5. PubMed ID: 11766813
[TBL] [Abstract][Full Text] [Related]
10. Estimating the physicochemical properties of polyhalogenated aromatic and aliphatic compounds using UPPER: part 2. Aqueous solubility, octanol solubility and octanol-water partition coefficient.
Admire B; Lian B; Yalkowsky SH
Chemosphere; 2015 Jan; 119():1441-1446. PubMed ID: 25454206
[TBL] [Abstract][Full Text] [Related]
11. Use of quantitative-structure property relationship (QSPR) and artificial neural network (ANN) based approaches for estimating the octanol-water partition coefficients of the 209 chlorinated trans-azobenzene congeners.
Wilczyńska-Piliszek AJ; Piliszek S; Falandysz J
J Environ Sci Health B; 2012; 47(2):111-28. PubMed ID: 22251211
[TBL] [Abstract][Full Text] [Related]
12. QSPR models of n-octanol/water partition coefficients and aqueous solubility of halogenated methyl-phenyl ethers by DFT method.
Zeng XL; Wang HJ; Wang Y
Chemosphere; 2012 Feb; 86(6):619-25. PubMed ID: 22115466
[TBL] [Abstract][Full Text] [Related]
13. Physico-chemical properties of PCDD/PCDFs and phthalate esters.
Saçan MT; Ozkul M; Erdem SS
SAR QSAR Environ Res; 2005 Oct; 16(5):443-59. PubMed ID: 16272043
[TBL] [Abstract][Full Text] [Related]
14. Prediction of octanol--air partition coefficients of semivolatile organic compounds based on molecular connectivity index.
Zhao H; Zhang Q; Chen J; Xue X; Liang X
Chemosphere; 2005 Jun; 59(10):1421-6. PubMed ID: 15876385
[TBL] [Abstract][Full Text] [Related]
15. Prediction of octanol-water partition coefficients of organic compounds by multiple linear regression, partial least squares, and artificial neural network.
Golmohammadi H
J Comput Chem; 2009 Nov; 30(15):2455-65. PubMed ID: 19360793
[TBL] [Abstract][Full Text] [Related]
16. Prediction of the retentions of polybrominated dibenzo-p-dioxins (PBDDs) by using the retentions of polychlorinated dibenzo-p-dioxins (PCDDs).
Liang X; Wang W; Wu W; Schramm KW; Henkelmann B; Oxynos K; Kettrup A
Chemosphere; 2000 Sep; 41(6):917-21. PubMed ID: 10864165
[TBL] [Abstract][Full Text] [Related]
17. Correlation of the photolysis half-lives of polychlorinated dibenzo-p-dioxins and dibenzofurans with molecular structure.
Katritzky AR; Slavov SH; Stoyanova-Slavova IB; Karelson M
J Phys Chem A; 2010 Feb; 114(7):2684-8. PubMed ID: 20112909
[TBL] [Abstract][Full Text] [Related]
18. [QSPR study on the lipid-water partition coefficients of dioxins based on DFT].
Gu CG; Jiang X; Bian YR; Yu GF
Huan Jing Ke Xue; 2008 May; 29(5):1330-5. PubMed ID: 18624202
[TBL] [Abstract][Full Text] [Related]
19. Prediction of aqueous solubility and partition coefficient optimized by a genetic algorithm based descriptor selection method.
Wegner JK; Zell A
J Chem Inf Comput Sci; 2003; 43(3):1077-84. PubMed ID: 12767167
[TBL] [Abstract][Full Text] [Related]
20. Effect of water on catalyzed de novo formation of polychlorinated dibenzo-p-dioxins and polychlorinated dibenzofurans.
Li XD; Zhang J; Yan JH; Chen T; Lu SY; Cen KF
J Hazard Mater; 2006 Sep; 137(1):57-61. PubMed ID: 16533559
[TBL] [Abstract][Full Text] [Related]
[Next] [New Search]