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  • Biochemistry and Biotechnology  (3)
  • Drug design  (2)
  • Lipophilicity  (1)
  • factorial design  (1)
  • 1
    Electronic Resource
    Electronic Resource
    Springer
    Journal of computer aided molecular design 5 (1991), S. 149-166 
    ISSN: 1573-4951
    Keywords: Aqueous solubility ; Partition coefficient ; Hydrophobicity ; Group contribution method ; Drug design ; Structure-property correlation
    Source: Springer Online Journal Archives 1860-2000
    Topics: Chemistry and Pharmacology
    Notes: Summary A computer program has been developed for estimating both the partition coefficient between 1-octanol and water phases and the aqueous solubility from the structural formula. This system is an extended version of a previously described program entitled CHEMICALC for the automatic estimation of the partition coefficient. The aqueous solubility is estimated via two pathways. The first is based on the linear relationship between logarithms of the aqueous solubilities of 497 compounds and their estimated 1-octanol/water partition coefficients. In the second, combined handling of two available group contribution methods of Irmann [Chem. Ing. Tech., 37 (1965) 789] and Wakita et al. [Chem. Pharm. Bull., 34 (1986) 4663] is adopted according to compound type. Some revisions and extensions of the methods for estimating the aqueous solubility have been made in both pathways, and the accuracy of the estimated aqueous solubilities for 497 compounds is discussed.
    Type of Medium: Electronic Resource
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  • 2
    Electronic Resource
    Electronic Resource
    Springer
    Journal of computer aided molecular design 4 (1990), S. 155-198 
    ISSN: 1573-4951
    Keywords: Partition coefficient ; Property estimation ; Hydrophobicity ; Lipophilicity ; Group-contribution method ; Drug design ; Structure-property correlation
    Source: Springer Online Journal Archives 1860-2000
    Topics: Chemistry and Pharmacology
    Notes: Summary A program for the automatic estimation of the logarithm of the partition coefficient between 1-octanol and water phases (log P) has been developed as a component of a system entitled CHEMICALC (Combined Handling of Estimation Methods Intended for Completely Automated Log P Calculation). Log P values are calculated based on additive group contributions to log P. Three sets of groups are defined, and their contributions have been derived from the experimental log P values of 1465 molecules. The system divides a structural formula of a compound of interest into the groups whose increments are provided and then calculates its log P value. All processing after structure input is fully automated. This system has been tested for predicting the log P values of 1686 compounds. The accuracy is sufficient for many practical purposes.
    Type of Medium: Electronic Resource
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  • 3
    Electronic Resource
    Electronic Resource
    New York, NY [u.a.] : Wiley-Blackwell
    Biotechnology and Bioengineering 27 (1985), S. 192-201 
    ISSN: 0006-3592
    Keywords: Chemistry ; Biochemistry and Biotechnology
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Biology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: Automatic constant-value control of mineral ions was attempted in semibatch culture of high cell mass concentration (more than 150 g dry cell/L) with ethanol and ammonia feeds. Equations were derived from the mass balance principle to calculate the required concentration of each mineral ion in the mineral feed solution, taking into account both the decrease in the volume of the culture supernatant as a proportion of the whole culture broth and the increase in the volume of the whole culture broth during the cultivation. The mineral solution was supplied automatically, linked either with ethanol feed or ammonia water feed. The actual concentrations of mineral ions could be kept within small variations. To adjust the supplementation in accordance with the culture change from oxygen sufficiency (early growth phase) to oxygen deficiency (later growth phase), the concentration of each mineral ion was altered stepwise when the dissolved oxygen concentration fell to zero. The mineral supplementation gave better results coupled with ethanol feed than with ammonia feed. The mineral ions studied were K+, Mg2+, Na+, Fe2+, Zn2+, Ca2+, Co2+, Cu2+, Mn2+, NH+4, PO43- and SO42-.
    Additional Material: 5 Ill.
    Type of Medium: Electronic Resource
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  • 4
    Electronic Resource
    Electronic Resource
    New York, NY [u.a.] : Wiley-Blackwell
    Biotechnology and Bioengineering 44 (1994), S. 1186-1192 
    ISSN: 0006-3592
    Keywords: ceramic membrane ; filtering culture ; retention culture ; oxygen transfer rate ; fouling ; Chemistry ; Biochemistry and Biotechnology
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Biology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: A novel reactor design incorporating porous ceramic tubes into a stirred jar fermentor was developed. The stirred ceramic membrane reactor has two ceramic tubular membrane units inside the vessel and maintains high filtration flux by alternating use for filtering and recovering from clogging. Each filter unit was linked for both extraction of culture broth and gas sparging. High permeability was maintained for long periods by applying the periodical control between filtering and air sparging during the stirred retention culture of Saccharomyces cerevisiae. The ceramic filter aeration system increased the kLa to about five times that of ordinary gas sparing. Using the automatic feeding and filtering system, cell mass concentration reached 207 g/L in a short time, while it was 64 g/L in a fed-batch culture. More than 99% of the growing cells were retained in the fermentor by the filtering culture. Both yield and productivity of cells were also increased by controlling the feeding of fresh medium and filtering the supernatant of the dense cells culture. © 1994 John Wiley & Sons, Inc.
    Additional Material: 10 Ill.
    Type of Medium: Electronic Resource
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  • 5
    Electronic Resource
    Electronic Resource
    Chichester : Wiley-Blackwell
    Journal of Chemical Technology AND Biotechnology 62 (1995), S. 351-358 
    ISSN: 0268-2575
    Keywords: carbon dioxide ; factorial design ; microalgae ; hydrodynamic stress ; bubble-column bioreactor ; Chemistry ; Biochemistry and Biotechnology
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Process Engineering, Biotechnology, Nutrition Technology
    Notes: Two kinds of bioreactors, a bubble-column and an air-lift bioreactor, have been designed. The influence of operating conditions such as medium composition, light intensity, carbon dioxide concentration in the flushing gas, culture temperature, and gas flow rate, on photosynthesis of Dunaliella tertiolecta were studied using a chemometrics approach. The bubble-column bioreactor system was shown to be advantageous over the air-life because of a weaker intensity of hydrodynamic stress derived from gas bubble dispersion and culture broth mixing. Optimal conditions for carbon dioxide fixation or maximal growth rate were determined. The effect of hydrodynamic shear forces on the algal wall produced by gas bubbling was identified as one of the most significant factors for algal growth.
    Additional Material: 10 Ill.
    Type of Medium: Electronic Resource
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