UID:
almafu_9960054789302883
Format:
1 online resource (XVIII, 325 p.)
ISBN:
9783110668896
Series Statement:
De Gruyter STEM ; Volume 2
Content:
Vol. 2 of Chemoinformatics of Natural Products introduces the reader to the currently available tools for toxicity prediction, drug property prediction, an enumeration of compounds, scaffolds and functional groups in nature, computational methods for lead identification, metabolite biosynthesis, etc. Selected case studies and hands-on tutorial exercises have been included.
Note:
Frontmatter --
,
Contents --
,
List of contributors --
,
About the Editor --
,
Part I: Advanced Chemoinformatics Concepts for Natural Product-based Drug Discovery --
,
1 An enumeration of natural products from microbial, marine and terrestrial sources --
,
2 A chemoinformatic analysis of atoms, scaffolds and functional groups in natural products --
,
3 Chemical similarity methods for analyzing secondary metabolite structures --
,
Part II: Advanced Chemoinformatics Tools and Methods for Lead Compound Discovery and Development --
,
4 Fragment-based drug design of nature-inspired compounds --
,
5 Prediction of modes of action of components of traditional medicinal preparations --
,
6 Mechanistic role of plant-based bitter principles and bitterness prediction for natural product studies I: Database and methods --
,
7 Mechanistic role of plant-based bitter principles and bitterness prediction for natural product studies II: prediction tools and case studies --
,
8 Toxicity of secondary metabolites --
,
Part III: Chemoinformatics Tools for Natural Products Discovery in the Modern Age and Case Studies --
,
9 Rational engineering of specialized metabolites in bacteria and fungi --
,
10 Epigenetic modification, co-culture and genomic methods for natural product discovery --
,
Part IV: Case Studies --
,
11 Case studies on computer-based identification of natural products as lead molecules --
,
12 A computer-based approach for developing linamarase inhibitory agents --
,
Part V: Tutorials and Glossary --
,
13 Searching natural product databases --
,
14 From genes to secondary metabolites --
,
Glossary of terms used in chemoinformatics of natural products: advanced concepts and applications --
,
Index
,
In English.
Additional Edition:
ISBN 9783110669060
Additional Edition:
ISBN 9783110668889
Language:
English
DOI:
10.1515/9783110668896
URL:
https://doi.org/10.1515/9783110668896
URL:
https://www.degruyter.com/isbn/9783110668896
URL:
https://doi.org/10.1515/9783110668896
URL:
https://www.degruyter.com/isbn/9783110668896
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