Method for Predicting the Migration Time of Ionic Compounds by Electrophoretic Measurement
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United States of America Patent
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Issued Date -
Nov 8, 2007
app pub date -
Aug 24, 2005
filing date -
Aug 25, 2004
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Abandoned
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Abstract
When the migration time of a low molecular weight compound having an unknown migration time in microchip electrophoresis, capillary electrophoresis, or a capillary electrophoresis mass spectrometer is predicted, first, with respect to a substance having a known electrophoretic migration time, characteristic quantities (descriptors) thereof which can be numerically expressed from a structure thereof are computed to predict the relation between the characteristic quantities (descriptors) and the migration time; the migration times of some substances are measured by electrophoresis or an electrophoresis mass spectrometer to learn about the relation; and using the learnt result, the migration time of the substance having an unknown migration time in the electrophoresis or electrophoresis mass spectrometer is predicted from the structure thereof.
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