Literature

So far, more than 260 peer reviewed papers have been published on the application of DryLab – a complete list of which you can find here.

DryLab draws on the philosophy described in the three most famous Solvophobic Theory papers IIIIII of Csaba Horváth, which were developed in the years 1975-1977 at Yale University (see also literature by Dr. Imre Molnár).

Read more about the Fundamentals of DryLab and its History.

Keyword Year

Computerized Design of Separation Strategies in Reversed-phase Liquid Chromatography: Development of DryLab software

I. Molnár
J. Chromatogr. A, 956 (2002)

Keywords: Method development, Resolution, Computer simulation, Resolution map, DryLab, Reviews, Quality control

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The development of the DryLab Software is a special achievement in analytical HPLC, which took place in the last 16 years. This paper tries to collect historical building stones and fundaments, which were laid down by the eminent work of Lloyd Snyder, John Dolan, Tom Jupille and many other enthusiastic scientist, from which DryLab has been put together to its state, where it is today. DryLab, being always a subject to changes, according to the needs of the user, never stopped to go on. Under the force of an ever changing science market, the development team of DryLab had to consider not just scientific improvements, but also new technological achievements, such as the introduction of Windows 1.0 and 3.1, later Windows NT and Windows 2000. The recent availability of new 32 bit program-ming tools allowed to carry out calculations of chromatograms much faster, to be able to show peak movements, which result of slight changes - for example - in eluent pH. DryLab is a great success of an interdisciplinary and intercontinental cooperation of many scientists.


Two-dimensional optimization using different pairs of variables for the reversed-phase high-performance liquid chromatographic separation of a mixture of acidic compounds

 T.H. Jupille, J.W. Dolan, L.R. Snyder, I. Molnár
J. Chromatogr. A, 948, 1-2, 35-41 (2002), DOI: 10.1016/S0021-9673(01)01587-4

Keywords: Optimization, Computer simulation, Method development, Resolution, Organic Acids

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For ionizable compounds such as organic acids, best results were obtained recently with simultaneous optimization of %B and pH, regardless of ionic strength or temperature. Changes in the pH of eluent A, adjusted to bracket the pK-values of acids (works also for bases and zwitterions), help to understand changes in critical resolution values due to shifts in peak positions.


Computer-assisted optimization in the development of a high-performance liquid chromatographic method for the analysis of kava pyrones in Piper methysticum preparations

A.H. Schmidt, I. Molnár
J. Chromatogr. A, 948, 51-63 (2002), DOI: 10.1016/S0021-9673(02)00066-3

Keywords: Optimization, Piper methysticum, Mobile phase composition, Plant materials, Pharmaceutical analysis, Method development, Computer simulation, Kava pyrones, Pyrones

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A new strategy for neutral compounds, contained in many phytopharmaceuticals, was presented at HPLC 2001 in Maastricht by Molnár and Schmidt. The systematic work with kava pyrones and three different organic modifiers, methanol, acetonitrile and 2-propanol, by simultanously changing gradient slope versus temperature or gradient slope versus pH reveals the true composition of such mixtures.


Advanced high-performance liquid chromatography method development: Discovering unexpected choices in chromatography

H.J. Rieger, I. Molnár
J. Chromatogr. A, 948, 1-2, 43–49 (2002)

Keywords: Method development, Optimization, Computer simulation, Resolution, Robustness testing, Liquid chromatography

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http://doi.org/10.1016/S0021-9673(02)00033-X

The analytical chemist is interested to learn more about the influence of the experimental parameters on the resolution, but can often only rely on experiments, he was able to carry out in a given time in a project. There are however often as many chances to improve resolution in the "unexpected" direction as by varying them in the "expected" way. The tools for understanding the method and discover all chances for improved selectivity are the different resolution maps.


Lipophilicity and pKa estimates from gradient high-performance liquid chromatography

Roman Kaliszan, Piotr Haber, Tomasz Ba̢czek, Danuta Siluk, Klara Valko
J. Chromatogr. A, 965, 117, 117–127 (2002), DOI: 10.1016/S0021-9673(02)00114-0

Keywords: Hydrophobicity, Lipophilicity, pKa, Gradient elution

http://www.sciencedirect.com/science/article/pi...

DryLab is used in a study in which the linear solvent strength model of gradient elution is applied to estimate parameters of lipophilicity and acidity of a series of drugs and model chemicals.


Computer Optimization of the RP-HPLC Separation of Some Taxoids from Yew Extracts

M. L. Hajnos, M. Waksmundzka-Hajnos, K. Glowniak
Acta Chromatographica, 12, 211-218 (2002)

http://yadda.icm.edu.pl/yadda/element/bwmeta1.e...

Drylab G software has been used to optimize the reversed-phase HPLC separation of taxoids and co-extracted substances from yew. Two preliminary runs based on a linear gradient from 5 to 100% acetonitrile (ACN) in 20 or 60 min were shown to be satisfactory for optimization of resolution. The optimization experiments were performed on a purified extract fortified with taxoid standards. The identity and purity of the peaks were verified by use of photodiode-array detection. Agreement between simulated and experimental data was good. The optimized chromatographic system can be used for quantitative analysis of paclitaxel, cephalomannine, and 10-deacetylbaccatin in yew extracts.

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