A short script to use the nontarget pattern.match function to print useful information about clusters.
You can not select more than 25 topics Topics must start with a letter or number, can include dashes ('-') and can be up to 35 characters long.
 
 
junikimm717 f24f59c93c added verbose output 3 years ago
src added verbose output 3 years ago
.gitignore began testing 3 years ago
LICENSE.md first commit 3 years ago
README.md added verbose output 3 years ago
specification.md cleaned up codebase 3 years ago

README.md

Patternmatch

This is a short R pattern.search wrapper that takes in a CSV file containing HRMS Peaks and prints all of the fragment numbers that may contain isotopes of one's choosing (preferably halogenated compounds).

Installation

The script has the following dependencies:

Before running/configuring the script, call make while in the /src directory or copy script.def.R to script.R.

Additional Notes

In order to make the search run in linear time, as of right now, the entire data table will be sorted before searching.