Generate conformers: using RDKit
toolshed.g2.bx.psu.edu/repos/bgruening/ctb_im_conformers/ctb_im_conformers/1.1.4+galaxy01.1.4+galaxy0
Metadata
Servers Offering this Tool
UseGalaxy.eu (1.1.4+galaxy0)This is a guess, we are not currently checking if that is actually present.
Observed Tool Versions
Within GTN tutorials
- 1.1.4+galaxy0
EDAM Operations
EDAM Topics
Relevant Tutorials
- Metabolomics / Predicting EI+ mass spectra with QCxMS