ChemRICH: ChemRICH Dataset
In MetChem: Chemical Structural Similarity Analysis
ChemRICH R Documentation
ChemRICH Dataset
Description
This dataset consists of a list of the metabolites names download from https://chemrich.fiehnlab.ucdavis.edu/. HMDB IDs were retrieved from PubChem Identifier Exchange Service (https://pubchem.ncbi.nlm.nih.gov/idexchange/idexchange.cgi) and manually curated.
Usage
data(ChemRICH)
Value
A list with the following elements in the variable ChemRICH:
name
A vector of metabolite's names.
SMILES
A vector of SMILES represenation of each metabolite.
HMDB
A vector containing HMDB IDs of each metabolite.
Examples
data(ChemRICH)
MetChem documentation built on June 8, 2025, 10:50 a.m.
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| ChemRICH | R Documentation |
ChemRICH Dataset
Description
This dataset consists of a list of the metabolites names download from https://chemrich.fiehnlab.ucdavis.edu/. HMDB IDs were retrieved from PubChem Identifier Exchange Service (https://pubchem.ncbi.nlm.nih.gov/idexchange/idexchange.cgi) and manually curated.
Usage
data(ChemRICH)Value
A list with the following elements in the variable ChemRICH:
name |
A vector of metabolite's names. |
SMILES |
A vector of SMILES represenation of each metabolite. |
HMDB |
A vector containing HMDB IDs of each metabolite. |
Examples
data(ChemRICH)
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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