Published February 28, 2025 | Version 1.0
Software Open

SulfurFinder

Authors/Creators

  • 1. University of British Columbia, Department of Chemistry

Description

SulfurFinder is an R program that integrates 1) data cleaning, 2) sulfur (S) recognition, and 3) S number prediction in nontargeted LC-HRMS data. The code is freely accessible on GitHub: https://github.com/HuanLab/SulfurFinder. The six machine learning (ML) models and demo data can be found here. 

 

 

Files

Files (447.9 MB)

Name Size Download all
md5:cef99ee4f5a1ac234978607ff6519ddc
39.7 kB Download
md5:96dcbe399d33f1ea307267cf3d299230
64.4 MB Download
md5:6077ae7c19406d6ac4399519c2a8d2c5
109.4 MB Download
md5:c671a523c89a83ed6f600ce93dd5aa5c
53.7 MB Download
md5:183660245fd7fcff3e90f36f395e95ca
92.5 MB Download
md5:5045cc0e7aa666a2f47f216c0c90093c
14.4 MB Download
md5:5ceff7beb652de6269e2556887982549
25.0 MB Download
md5:d5f4fb6dfe1dbbeb9dd4c318074dce77
43.6 MB Download
md5:5972dbd927f99078f5b9028b7e30ddd6
44.9 MB Download

Additional details

Software

Repository URL
https://github.com/HuanLab/SulfurFinder
Programming language
R