Cheminformatics Tutorials Herong s Tutorial Examples is popular PDF and ePub book, written by Herong Yang in 2022-04-01, it is a fantastic choice for those who relish reading online the Science genre. Let's immerse ourselves in this engaging Science book by exploring the summary and details provided below. Remember, Cheminformatics Tutorials Herong s Tutorial Examples can be Read Online from any device for your convenience.
Cheminformatics Tutorials Herong s Tutorial Examples Book PDF Summary
This book is a collection of notes and tutorial examples written by the author while he was learning cheminformatics and related tools. Topics include SMILES (Simplified Molecular-Input Line-Entry System) specifications; Open Babel chemical toolbox for file format conversion; Fingerprint index files used by Open Babel for fast search; RDKit for cheminformatics and machine learning; Substructure search and decomposition with RDKit; RDKit performance on large molecule datasets; AlphaFold as an AI system to predict protein’s 3D structure. Updated in 2023 (Version v1.24) with minor updates. For latest updates and free sample chapters, visit https://www.herongyang.com/Cheminformatics.
Detail Book of Cheminformatics Tutorials Herong s Tutorial Examples PDF
- Author : Herong Yang
- Release : 01 April 2022
- Publisher : HerongYang.com
- ISBN : 978186723xxxx
- Genre : Science
- Total Page : 474 pages
- Language : English
- PDF File Size : 7,5 Mb
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