title: Application of Sigmoidal Transformation Functions in Optimization of Micellar Liquid Chromatographic Separation of Six Quinolone Antibiotics.
abstract: A chemometrics approach has been used to optimize the separation of six quinolone compounds by micellar liquid chromatography (MLC). A Derringer's desirability function, a multicriteria decision-making (MCDM) method, was tested for evaluation of two different measures of chromatographic performance (resolution and analysis time). The effect of three experimental parameters on a chromatographic response function (CRF) expressed as a product of two sigmoidal desirability functions was investigated. The sigmoidal functions were used to transform the optimization criteria, resolution and analysis time into the desirability values. The factors studied were the concentration of sodium dodecyl sulfate, butanol content and pH of the mobile phase. The experiments were done according to the face-centered cube central composite design, and the calculated CRF values were fitted to a polynomial model to correlate the CRF values with the variables and their interactions. The developed regression model showed good descriptive and predictive ability (R(2) = 0.815, F = 6.919, SE = 0.038, [Formula: see text]) and used, by a grid search algorithm, to optimize the chromatographic conditions for the separation of the mixture. The efficiency of prediction of polynomial model was confirmed by performing the experiment under the optimal conditions.
authors.affiliation: Department of Analytical Chemistry, Faculty of Chemistry, University of Mazandaran, Babolsar, Iran hadjmr@umz.ac.ir.
authors.forename: Mohammadreza
authors.initials: M
authors.lastname: Hadjmohammadi
authors.affiliation: Department of Analytical Chemistry, Faculty of Chemistry, University of Mazandaran, Babolsar, Iran.
authors.forename: Mina
authors.initials: M
authors.lastname: Salary
mesh_terms: D020001:1-Butanol; D000465:Algorithms; D000900:Anti-Bacterial Agents / Q000302:isolation & purification*; D002851:Chromatography, High Pressure Liquid / Q000295:instrumentation / Q000379:methods*; D005021:Ethylamines; D005163:Factor Analysis, Statistical; D006863:Hydrogen-Ion Concentration; D008823:Micelles; D015233:Models, Statistical; D010756:Phosphoric Acids; D015363:Quinolones / Q000302:isolation & purification*; D012967:Sodium Dodecyl Sulfate; D012996:Solutions; D012997:Solvents
chemical_list: D000900:Anti-Bacterial Agents; D005021:Ethylamines; D008823:Micelles; D010756:Phosphoric Acids; D015363:Quinolones; D012996:Solutions; D012997:Solvents; D012967:Sodium Dodecyl Sulfate; D020001:1-Butanol; C030242:phosphoric acid; C016162:triethylamine