Description Usage Arguments Value See Also Examples
View source: R/get_classification.R
Retrieve entity classification from ‘http://classyfire.wishartlab.com/entities/’. The optional local cache function enables classification requests with less waiting time. Furthermore, there will be fewer traffic on the classyFire servers. For best high efficiency there is an option for creating a SQLight database to cache results.
1 | get_classification(inchi_key, conn = NULL)
|
inchi_key |
a character string of a valid InChIKey |
conn |
a DBIConnection object, as produced by dbConnect |
a ClassyFire
S4 object.
ClassyFire-class
1 2 3 4 5 6 7 8 9 10 11 12 | ## Not run:
# Valid InChI key where all four classification levels are available
get_classification('BRMWTNUJHUMWMS-LURJTMIESA-N')
# Valid InChI key where only three classification levels are available
get_classification('MDHYEMXUFSJLGV-UHFFFAOYSA-N')
# Invalid InChI key
get_classification('MDHYEMXUFSJLGV-UHFFFAOYSA-B')
## End(Not run)
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