The<i>CSD</i>and knowledge databases: from answers to questions
Alexander P. Shevchenko, Roman A. Eremin, Vladislav A. Blatov
Abstract
We develop tools for extracting new information on crystal structures from crystallographic databases and show how to use these tools in the design of coordination compounds.
Topics & Concepts
DatabaseComputer scienceInformation retrievalX-ray Diffraction in CrystallographyMetal-Organic Frameworks: Synthesis and ApplicationsMachine Learning in Materials Science