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This work provides a comprehensive and critical overview of all the main classes of theoretical molecular descriptors. It reviews computational methods that can be employed in the development of QSAR and QSPR equations.

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.

Boekdetails

Formaat
Hardback
Uitgever
John Wiley & Sons Inc
Imprint
Wiley-Interscience
Auteur
Mati Karelson (University of Tartu), Wiley-Interscience, John Wiley & Sons Inc
ISBN-13
9780471351689
Verschijningsdatum
2000-02-24
Pagina's
448
Afmetingen
164 mm × 243 mm × 31 mm
Gewicht
880 g
Land van herkomst
US

Hardback

Molecular Descriptors in QSAR/QSPR

door Mati Karelson (University of Tartu)

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