README.md

In rformassspectrometry/CompoundDb: Creating and Using (Chemical) Compound Annotation Databases

CompoundDb ... preserve compound annotations.

Installation and requirements

The package can be installed with

install.packages(c("BiocManager", "remotes"))
BiocManager::install("RforMassSpectrometry/CompoundDb")

Creating and using (chemical) compound databases

This package provides functionality to create and use compound databases generated from (mostly publicly) available resources such as HMDB, ChEBI and PubChem.

How to contribute

Contributions are welcome, but should follow certain guidelines: 1) Open an issue. 2) Create a new branch (internal collaborator) or fork the repository (external contributor). 3) Add your code (following loosly Bioconductor's coding style. 4) Ensure the package passes R CMD build and R CMD check. 5) Make a pull request.

rformassspectrometry/CompoundDb documentation built on March 20, 2023, 3:36 p.m.