Chemmine R

syn26483540

Created By Mette Peters Mette

url: https://bioconductor.org/packages/release/bioc/vignettes/ChemmineR/inst/doc/ChemmineR.html
grant: U19AG023122 U24AG051129
program: ELITE
project: LC
summary: Comprehensive cheminformatics toolkit for managing, searching and analyzing drug-like small molecule data in R.
toolType: Chemoinformatics
isFeatured: false
contributor: Thomas Girke
displayName: ChemmineR
institution: University of California, Riverside
resourceType: softwareTool
softwareType: R/Bioconductor package
toolHomepage: https://bioconductor.org/packages/ChemmineR/
documentation: https://www.bioconductor.org/packages/release/bioc/vignettes/ChemmineR/inst/doc/ChemmineR.html
toolInputData: chemical structures
toolOperation: Over 100 cheminformatics and clustering functions
toolOutputData: tables plots structures
toolInputFormat: computer readable structures or identifier strings
projectShortName: LC
toolOutputFormat: R and C++

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