combine.smi: Combine compounds together, removing duplicates warn if there...
In momeara/SEAR: R Tools for working with the Similarity Ensemble Approach Program
Description
INPUT:
smis: named list of smi data.frames with at least columns [smiles, compound]
smiles: name of smiles column in smi data.frames
compound: name of compound column in smi data.frame
Usage
1
combine.smi(smis, smiles = "smiles", compound = "compound")
Details
OUTPUT:
data.frame: columns of smis and column <set>
momeara/SEAR documentation built on May 23, 2019, 6:09 a.m.
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Description
INPUT: smis: named list of smi data.frames with at least columns [smiles, compound] smiles: name of smiles column in smi data.frames compound: name of compound column in smi data.frame
Usage
1 | combine.smi(smis, smiles = "smiles", compound = "compound")
|
Details
OUTPUT: data.frame: columns of smis and column <set>
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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