Molecular descriptors in QSAR/QSPR
著者
書誌事項
Molecular descriptors in QSAR/QSPR
Wiley-Interscience, c2000
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注記
Includes bibliographical references and index
1 CD-ROM in pocket (12 cm)
内容説明・目次
内容説明
Molecular descriptors are mathematical values that describe the structure or shape of molecules, helping predict the activity and properties of molecules in complex experiments. This book describes the equations known as QSAR (quantitative structure-activity relationships) and QSPR (quantitative structure-property relationships), showing how they can be used productively in a wide range of industries.
目次
Empirical Molecular Descriptors.
Theoretical Molecular Descriptors.
Methods for the Development of QSAR/QSPR.
Appendix.
Index.
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