Collections:
Show InChI and InChIKey on JSME
How to display the InChI string and InChIKey of the molecule in JSME editor?
✍: FYIcenter.com
JSME does not offer any API methods to export the InChI string
and InChIKey of the molecule in the editor.
But you can display them on the editor UI.
1. Follow the previous tutorial to install JSME on your Web server.
2. Run the demo page on the Apache Web server by opening "http://localhost/jsme/JSME.html" URL in a Web browser.
3. Select the "benzene ring" icon from the JSME editor menu and click a location inside the editor. You see a benzene ring molecule created.
4. Select the "export & import" icon from the menu and select "Copy as InChI". You see the InChI string "InChI=1S/C6H6/c1-2-4-6-5-3-1/h1-6H" displayed.
⇒ Build Molecule Pattern in JSME
⇐ JSME User Interface Menu Icons
2020-05-18, 990👍, 0💬
Popular Posts:
Tools: Convert SMILES Search by Name Search by InChIKey SDF Viewer Molecule Editor Collections: 3Dmo...
What Is "obconformer" command? How to use it to generate the best conformer from a base molecule? "o...
How to perform exact match in fastsearch index file using a "babel" command? If you want to perform ...
How to run OpenBabelGUI on Windows computers? Open Babel GUI is the graphical user interface for Ope...
What Is SDF/Mol V3000 file format? SDF (Structural Data File) V3, also call Mol V3000 file, or Molfi...