Zakodium

For over 20 years, ChemCalc (www.chemcalc.org) has been a free tool for molecular formula analysis and mass spectrometry. What's new: • Isotopic distribution from small molecules to proteins — visualize what you actually observe in your mass spectra • Interactive exercises — randomly generated problems to learn charge determination, monoisotopic mass calculation, and isotopic pattern recognition. No login, progress tracked locally. • Revamped REST API — ready-to-use examples in JavaScript, Python, and R. Integrate ChemCalc into your Jupyter notebooks, R scripts, or data pipelines.

𝗬𝗼𝘂𝗿 𝗡𝗠𝗥 𝗱𝗮𝘁𝗮 𝘀𝗵𝗼𝘂𝗹𝗱 𝗻𝗲𝘃𝗲𝗿 𝗯𝗲 𝘁𝗿𝗮𝗽𝗽𝗲𝗱 𝗶𝗻 𝗮 𝗽𝗿𝗼𝗽𝗿𝗶𝗲𝘁𝗮𝗿𝘆 𝗳𝗼𝗿𝗺𝗮𝘁. With the latest version of NMRium (https://www.nmrium.com), we're introducing a new file format: .nmrium.zip The concept is refreshingly simple: we take your original data files — Bruker, JCAMP-DX, JEOL, whatever you use — and zip them as-is. Alongside, we store all your processing and analysis (phase correction, peak picking, multiplet analysis, integrations, assignments...) as a simple JSON file. That's it. No conversion. No proprietary binary. Your raw data stays untouched. What does this mean for you? → Switch platforms anytime — your original data is right there, unmodified → Parse your processing with any external tool — it's just JSON → Archive with confidence — it's a ZIP file, it will open in 50 years → Stay FAIR-compliant by design, not by promise NMRium is a 100% browser-based NMR processing platform. No installation, no OS dependency — just drag and drop your spectra and start working. And now, your work is saved in a format that truly respects your data ownership. Full format spec at: https://lnkd.in/e-huXqbr #NMR #OpenScience #NMRium #FAIR #OpenData #Chemistry #Spectroscopy #ReproducibleScience

Learn NMRium in Action! Join us this Friday for a 2-hour eWorkshop hosted by the Society of Medicinal Plant and Natural Product Research and discover how to process and visualize NMR spectra using NMRium. Don’t miss it – register here: https://lnkd.in/gyHviv7E

The Zakodium electronic laboratory notebook, SciPeaks, now integrates NMRium, enabling you to visualize and process NMR spectra directly in your browser — no extra software needed. By unifying reaction recording, data management, analysis, and reporting in one platform, SciPeaks helps you spend less time juggling tools and more time accelerating scientific discovery. You can try it out here: https://demo.scipeaks.com, and if you’d like to discuss your workflows or see more features, I’d be happy to arrange a short Zoom call. #SciPeaks #NMRium #Chemistry #ResearchTools #DataVisualization #ELN

We just released ImageJS 1.0! 🎉 ImageJS is a library written in TypeScript which can do common image processing tasks such as filtering, geometrical transformation, color correction and much more. It supports the web browser and Node.js. It's open source like many other libraries maintained by Zakodium! You can learn more about it here: https://docs.image-js.org/ Special thank you to Maxim Golubev for the recent work and also to Océane Patiny for the massive contributions to the library. #TypeScript #NodeJS #ImageProcessing

A big thank you to Luc Patiny for the presentation of your powerful online #NMR software during the Future Labs Live Basel last week - and for the mug! Pretty sure #chemists will appreciate using your software. Excited to see what the future holds for NMRium! Randstad Switzerland #PartnerForTalent

What a great pleasure being and presenting at #FutureLabsLive2025 in Basel, which left us full of energy and motivation. A lot of very meaningful interactions and a great opportunity for us to showcase https://www.nmrium.org/ and our other web technologies in the analytical sciences.