Warning: Undefined array key "mm" in /www/wwwroot/www.ai-bt.com/si.php on line 10 Deprecated: trim(): Passing null to parameter #1 ($string) of type string is deprecated in /www/wwwroot/www.ai-bt.com/si.php on line 10 A new and simple approach to chemical complexity. Application to the synthesis of natural products.

Literature DB >> 11277709

A new and simple approach to chemical complexity. Application to the synthesis of natural products.

Abstract

A new approach to describe the complexity of chemical structures is proposed. This index is simple and can be easily programmed. It derives from Whitlock's index and, despite its empirical character, provides results paralleling those obtained with the mathematical Bertz index. It has been applied to follow the strategic progress of some natural product syntheses.

Year: 2001 PMID： 11277709 DOI： 10.1021/ci000145p

Source DB: PubMed Journal: J Chem Inf Comput Sci ISSN： 0095-2338

Keyword Cloud
Cited

7 in total

Review 1. Global analysis of large-scale chemical and biological experiments.

Authors: David E Root; Brian P Kelley; Brent R Stockwell
Journal: Curr Opin Drug Discov Devel Date: 2002-05

2. Genome-Edited Coincidence and PMP22-HiBiT Fusion Reporter Cell Lines Enable an Artifact-Suppressive Quantitative High-Throughput Screening Strategy for PMP22 Gene-Dosage Disorder Drug Discovery.

Authors: Natalia J Martinez; John C Braisted; Patricia K Dranchak; John J Moran; Hunter Larson; Bryan Queme; Evgenia Pak; Amalia Dutra; Ganesha Rai; Ken Chih-Chien Cheng; John Svaren; James Inglese
Journal: ACS Pharmacol Transl Sci Date: 2021-06-10

A new and simple approach to chemical complexity. Application to the synthesis of natural products.

Review 1. Global analysis of large-scale chemical and biological experiments.

2. Genome-Edited Coincidence and PMP22-HiBiT Fusion Reporter Cell Lines Enable an Artifact-Suppressive Quantitative High-Throughput Screening Strategy for PMP22 Gene-Dosage Disorder Drug Discovery.

3. Structure and reaction based evaluation of synthetic accessibility.

4. Nonpher: computational method for design of hard-to-synthesize structures.

5. SYBA: Bayesian estimation of synthetic accessibility of organic compounds.

6. From Molecules to Life: Quantifying the Complexity of Chemical and Biological Systems in the Universe.

7. Molecular Complexity Calculated by Fractal Dimension.