getMolFromDrugBank: Retrieve Drug Molecules in MOL Format from the DrugBank...
In nanxstats/Rcpi: Molecular Informatics Toolkit for Compound-Protein Interaction in Drug Discovery
getMolFromDrugBank R Documentation
Retrieve Drug Molecules in MOL Format from the DrugBank Database
Description
Retrieve Drug Molecules in MOL Format from the DrugBank Database
Usage
getMolFromDrugBank(id, parallel = 5)
Arguments
id
A character vector, as the DrugBank 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 5.
For regular cases, we recommend a number less than 20.
Details
This function retrieves drug molecules in MOL format from the
DrugBank database.
Value
A length of id character vector,
each element containing the corresponding drug molecule.
See Also
See getSmiFromDrugBank for retrieving drug molecules
in SMILES format from the DrugBank database.
Examples
id = 'DB00859' # Penicillamine
getMolFromDrugBank(id)
nanxstats/Rcpi documentation built on Sept. 24, 2024, 9:36 a.m.
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| getMolFromDrugBank | R Documentation |
Retrieve Drug Molecules in MOL Format from the DrugBank Database
Description
Retrieve Drug Molecules in MOL Format from the DrugBank Database
Usage
getMolFromDrugBank(id, parallel = 5)
Arguments
id |
A character vector, as the DrugBank 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 |
Details
This function retrieves drug molecules in MOL format from the DrugBank database.
Value
A length of id character vector,
each element containing the corresponding drug molecule.
See Also
See getSmiFromDrugBank for retrieving drug molecules
in SMILES format from the DrugBank database.
Examples
id = 'DB00859' # Penicillamine
getMolFromDrugBank(id)
R Package Documentation
Browse R Packages
We want your feedback!
Note that we can't provide technical support on individual packages. You should contact the package authors for that.
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