Workflow Steps and Code Snippets
1 tagged steps and code snippets that match keyword InChIKey
Calculate the half maximal inhibitory concentration (IC50) for each compound used in a SARS-CoV-2 study (Version 1)
41 42 | compoundName <- "Remdesivir" inChIKey <- "RWWYLEGWBNMMLJ-YSOARWBDSA-N" |
format / edam
InChIKey
The InChIKey (hashed InChI) is a fixed length (25 character) condensed digital representation of an InChI chemical structure specification. It uniquely identifies a chemical compound.|An InChIKey identifier is not human- nor machine-readable but is more suitable for web searches than an InChI chemical structure specification.
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