2020 journal article

SIME: synthetic insight-based macrolide enumerator to generate the V1B library of 1 billion macrolides

JOURNAL OF CHEMINFORMATICS, 12(1).

By: P. Zin n, G. Williams n & D. Fourches n

author keywords: Macrolides; PKS enumerator; In silico chemical library software; Polyketides
TL;DR: A new cheminformatics enumeration technology—SIME, synthetic insight-based macrolide enumerator—a new and improved software technology that can enumerate fully assembled macrolides with synthetic feasibility by utilizing the constitutional and structural knowledge extracted from biosynthetic aspects of macrolided. (via Semantic Scholar)
Source: Web Of Science
Added: April 27, 2020

Abstract