Name: A Primer on Qsar (en Inglés)
Price: 74.02 USD
Availability: InStock
Author: Kunal Roy; Supratik Kar; Rudra Narayan Das
ISBN: 9783319172804

Formato

Libro Físico

Editorial

Springer

Autor

Kunal Roy; Supratik Kar; Rudra Narayan Das

Año

2015

Idioma

Inglés

N° páginas

132

Encuadernación

Tapa Blanda

ISBN13

9783319172804

N° edición

2015

Categorías

Química física

A Primer on Qsar (en Inglés)

Kunal Roy; Supratik Kar; Rudra Narayan Das (Autor) · Springer · Tapa Blanda

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Reseña del libro "A Primer on Qsar (en Inglés)"

This brief goes back to basics and describes the Quantitative structure-activity/property relationships (QSARs/QSPRs) that represent predictive models derived from the application of statistical tools correlating biological activity (including therapeutic and toxic) and properties of chemicals (drugs/toxicants/environmental pollutants) with descriptors representative of molecular structure and/or properties. It explains how the sub-discipline of Cheminformatics is used for many applications such as risk assessment, toxicity prediction, property prediction and regulatory decisions apart from drug discovery and lead optimization. The authors also present, in basic terms, how QSARs and related chemometric tools are extensively involved in medicinal chemistry, environmental chemistry and agricultural chemistry for ranking of potential compounds and prioritizing experiments. At present, there is no standard or introductory publication available that introduces this important topic to students of chemistry and pharmacy. With this in mind, the authors have carefully compiled this brief in order to provide a thorough and painless introduction to the fundamental concepts of QSAR/QSPR modelling. The brief is aimed at novice readers.