getMolFromChEMBL {Rcpi} | R Documentation |
Retrieve Drug Molecules in MOL Format from the ChEMBL Database
getMolFromChEMBL(id, parallel = 5)
id |
A character vector, as the ChEMBL drug ID. |
parallel |
An integer, the parallel parameter, indicates how many
process the user would like to use for
retrieving the data (using RCurl), default is |
This function retrieves drug molecules in MOL format from the ChEMBL database.
A length of id
character vector,
each element containing the corresponding drug molecule.
Nan Xiao <https://nanx.me>
See getSmiFromChEMBL
for retrieving drug molecules
in SMILES format from the ChEMBL database.
id = 'CHEMBL1430' # Penicillamine getMolFromChEMBL(id)