144 related articles for article (PubMed ID: 36625152)
1. In silico package models for deriving values of solute parameters in linear solvation energy relationships.
Xiao ZJ; Chen JW; Wang Y; Wang ZY
SAR QSAR Environ Res; 2023 Jan; 34(1):21-37. PubMed ID: 36625152
[TBL] [Abstract][Full Text] [Related]
2. Hydrogen bonding. 32. An analysis of water-octanol and water-alkane partitioning and the delta log P parameter of seiler.
Abraham MH; Chadha HS; Whiting GS; Mitchell RC
J Pharm Sci; 1994 Aug; 83(8):1085-100. PubMed ID: 7983591
[TBL] [Abstract][Full Text] [Related]
3. Partition Coefficients of Organics between Water and Carbon Dioxide Revisited: Correlation with Solute Molecular Descriptors and Solvent Cohesive Properties.
Roth M
Environ Sci Technol; 2016 Dec; 50(23):12857-12863. PubMed ID: 27792336
[TBL] [Abstract][Full Text] [Related]
4. Recent advances for estimating environmental properties for small molecules from chromatographic measurements and the solvation parameter model.
Poole CF; Atapattu SN
J Chromatogr A; 2023 Jan; 1687():463682. PubMed ID: 36502643
[TBL] [Abstract][Full Text] [Related]
5. Linear solvation energy relationships (LSERs) for robust prediction of partition coefficients between low density polyethylene and water. Part II: Model evaluation and benchmarking.
Egert T; Langowski HC
Eur J Pharm Sci; 2022 May; 172():106138. PubMed ID: 35122951
[TBL] [Abstract][Full Text] [Related]
6. The effect of descriptor database selection on the physicochemical characterization and prediction of water-air, octanol-air and octanol-water partition constants using the solvation parameter model.
Poole CF
J Chromatogr A; 2023 Sep; 1706():464213. PubMed ID: 37567000
[TBL] [Abstract][Full Text] [Related]
7. Predicting Leachables Solubilization in Polysorbate 80 Solutions by a Linear Solvation Energy Relationship (LSER).
Strobel AB; Egert T; Langguth P
Pharm Res; 2021 Sep; 38(9):1549-1561. PubMed ID: 34580792
[TBL] [Abstract][Full Text] [Related]
8. A general linear free energy relationship for predicting partition coefficients of neutral organic compounds.
Chen D; Wang Q; Li Y; Li Y; Zhou H; Fan Y
Chemosphere; 2020 May; 247():125869. PubMed ID: 31972487
[TBL] [Abstract][Full Text] [Related]
9. Estimation of partitioning parameters of nonionic surfactants using calculated descriptors of molecular size, polarity, and hydrogen bonding.
Altomare C; Carotti A; Trapani G; Liso G
J Pharm Sci; 1997 Dec; 86(12):1417-25. PubMed ID: 9423157
[TBL] [Abstract][Full Text] [Related]
10. Determination of solute descriptors by chromatographic methods.
Poole CF; Atapattu SN; Poole SK; Bell AK
Anal Chim Acta; 2009 Oct; 652(1-2):32-53. PubMed ID: 19786169
[TBL] [Abstract][Full Text] [Related]
11. Chemical selectivity in micellar electrokinetic chromatography: characterization of solute-micelle interactions for classification of surfactants.
Yang S; Khaledi MG
Anal Chem; 1995 Feb; 67(3):499-510. PubMed ID: 7893000
[TBL] [Abstract][Full Text] [Related]
12. Molecular descriptors of N-arylhydroxamic acids: a tool in drug design.
Tiwari V; Pande R
Chem Biol Drug Des; 2006 Oct; 68(4):225-8. PubMed ID: 17105487
[TBL] [Abstract][Full Text] [Related]
13. Ionic liquids: predictions of physicochemical properties with experimental and/or DFT-calculated LFER parameters to understand molecular interactions in solution.
Cho CW; Preiss U; Jungnickel C; Stolte S; Arning J; Ranke J; Klamt A; Krossing I; Thöming J
J Phys Chem B; 2011 May; 115(19):6040-50. PubMed ID: 21504151
[TBL] [Abstract][Full Text] [Related]
14. The influence of descriptor database selection on the solvation parameter model for separation processes.
Poole CF
J Chromatogr A; 2023 Mar; 1692():463851. PubMed ID: 36773399
[TBL] [Abstract][Full Text] [Related]
15. Predicting partitioning from low density polyethylene to blood and adipose tissue by linear solvation energy relationship models.
Ulrich N; Böhme A; Strobel AB; Egert T
J Biomed Mater Res B Appl Biomater; 2023 Dec; 111(12):2044-2054. PubMed ID: 37498141
[TBL] [Abstract][Full Text] [Related]
16. Characterization of sorption mechanisms of VOCs with organobentonites using a LSER approach.
Tian S; Zhu L; Shi Y
Environ Sci Technol; 2004 Jan; 38(2):489-95. PubMed ID: 14750724
[TBL] [Abstract][Full Text] [Related]
17. Solvation descriptors for the polychloronaphthalenes: estimation of some physicochemical properties.
Abraham MH; al-Hussaini AJ
J Environ Monit; 2001 Aug; 3(4):377-81. PubMed ID: 11523436
[TBL] [Abstract][Full Text] [Related]
18. Modelling of retention of pesticides in reversed-phase high-performance liquid chromatography: quantitative structure-retention relationships based on solute quantum-chemical descriptors and experimental (solvatochromic and spin-probe) mobile phase descriptors.
D'Archivio AA; Ruggieri F; Mazzeo P; Tettamanti E
Anal Chim Acta; 2007 Jun; 593(2):140-51. PubMed ID: 17543600
[TBL] [Abstract][Full Text] [Related]
19. Physicochemical properties/descriptors governing the solubility and partitioning of chemicals in water-solvent-gas systems. Part 1. Partitioning between octanol and air.
Raevsky OA; Grigor'ev VJ; Raevskaja OE; Schaper KJ
SAR QSAR Environ Res; 2006 Jun; 17(3):285-97. PubMed ID: 16815768
[TBL] [Abstract][Full Text] [Related]
20. Hydrogen-bonding. Part 36. Determination of blood brain distribution using octanol-water partition coefficients.
Abraham MH; Chadha HS; Mitchell RC
Drug Des Discov; 1995 Nov; 13(2):123-31. PubMed ID: 8872456
[TBL] [Abstract][Full Text] [Related]
[Next] [New Search]