Quantitative in Silico Chromatography
Computational Modelling of Molecular Interactions
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Combining computational and theoretical techniques with advanced chromatographic methods offers a powerful tool for quantitatively determining the molecular interactions taking place in separation and biological systems . Written by the author of HPLC: A Practical Guide (RSC, 1999), the book uses computational models to examine the interactions of analytes, including many biological molecules, in chromatographic systems and extends these models to the behaviour of proteins in of biological reactions per se. Various software packages are reviewed, and most computations can be performed on a sta...
Combining computational and theoretical techniques with advanced chromatographic methods offers a powerful tool for quantitatively determining the molecular interactions taking place in separation and biological systems . Written by the author of HPLC: A Practical Guide (RSC, 1999), the book uses computational models to examine the interactions of analytes, including many biological molecules, in chromatographic systems and extends these models to the behaviour of proteins in of biological reactions per se. Various software packages are reviewed, and most computations can be performed on a standard PC using accessible software. Consideration is given to a variety of chromatographic techniques and strategies for high-sensitivity detection are presented. The first book of its kind, it will inspire readers to explore the possibilities of combining these techniques in their own work, whether at an industrial or academic level.
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