NMRium

React component to display and process nuclear magnetic resonance (NMR) spectra.

Maintained by Zakodium

Use it

Visit https://www.nmrium.org for examples of usage.

Use as a library in a React project

Install the package

npm install nmrium

OpenChemLib version

This module makes use of openchemlib/full.
If you use OpenChemLib somewhere else in your project, make sure to also import from openchemlib/full to avoid having multiple OCL versions in your bundle.

Use the component

import NMRium from 'nmrium';

function MyComponent() {
  return <NMRium />;
}

Development and testing

See General information for NMRium development.

There is an automatic build on each commit. You can test the latest build from main at:

https://dev.nmrium.org/

Want to play ? You can do some 1D NMR exercises ;)

https://www.nmrium.org/teaching#?toc=https://cheminfo.github.io/nmr-dataset2/toc.json

Also you can do some 2D NMR exercises ;)

https://www.nmrium.org/teaching#?toc=https://cheminfo.github.io/nmr-dataset1/data/2d.json

https://dev.nmrium.org?sampleURL=https%3A//cheminfo.github.io/nmr-dataset1/data/2d.json

You can do some 1D NMR tests/ exams ;)

https://dev.nmrium.org?sampleURL=https%3A//cheminfo.github.io/nmr-dataset2/exam.json

If you have jcamps accessible from an URL and that your server allow cross-origin you can directly open your file in the demo application:

https://dev.nmrium.org?sampleURL=https%3A//cheminfo.github.io/nmr-dataset2/100-86-7/1h.dx

Link loading the default samples test cases

https://dev.nmrium.org/?sampleURL=samples.json

You can debug Data and onDataChange callback ;)

https://dev.nmrium.org/#/test

Install and test locally

git clone https://github.com/cheminfo/nmrium.git
cd nmrium
npm i
npm start

Funding

	Zakodium sàrl
	Initiative zur Verbesserung der NMR-Datenqualität (IDNMR)
	NFDI4Chem Chemistry Consortium in the NFDI
	Universidad del Valle / Cali, Colombia
	This project has received funding from the European Union’s Horizon 2020 research and innovation programme under grant agreement No 957189. The project is part of BATTERY 2030+, the large-scale European research initiative for inventing the sustainable batteries of the future.

License

MIT