A Python module for processing NMR spectra.
☆38Jun 23, 2026Updated this week
Alternatives and similar repositories for nmrpy
Users that are interested in nmrpy are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- A python module to import NMR data stored in Bruker / TopSpin, TecMag / NTNMR, Magritek / Kea or Chemagnetics / Spinsight format☆38Feb 24, 2026Updated 4 months ago
- A module for working with NMR data in Python☆267Jun 22, 2026Updated last week
- React component to display and process nuclear magnetic resonance (NMR) spectra.☆81Updated this week
- Small angle scattering tools ... but unlike most others, free.☆12Mar 16, 2026Updated 3 months ago
- nmrML is an open mark-up language for NMR data. This is the official repository for development of the nmrML schema and NMR ontology.☆33Mar 27, 2025Updated last year
- Deploy on Railway without the complexity - Free Credits Offer • AdConnect your repo and Railway handles the rest with instant previews. Quickly provision container image services, databases, and storage volumes.
- Automated spectraL Processing System for NMR☆17Sep 24, 2025Updated 9 months ago
- Python module for parsing, writing, aligning, and manipulating glycan structrures☆10Updated this week
- A fast solid-state NMR spectrum simulation and analysis library.☆47Dec 15, 2025Updated 6 months ago
- Analyzing thin-layer chromatography (TLC) chromatograms☆18May 6, 2024Updated 2 years ago
- Flowchem is an application to simplify the control of instruments and devices commonly found in chemistry labs.☆21Updated this week
- A Python library for NMR simulation☆29Jan 15, 2024Updated 2 years ago
- A geometric deep learning model for predicting molecular tensorial properties and selected spectra with high accurately and efficiency☆14Nov 10, 2024Updated last year
- code for "Automated and Intelligent Synthesis of Oxygen-Producing Catalysts from Martian Meteorites by Robotic AI-Chemist "☆12Jul 31, 2023Updated 2 years ago
- ☆17Sep 4, 2022Updated 3 years ago
- AI Agents on DigitalOcean Gradient AI Platform • AdBuild production-ready AI agents using customizable tools or access multiple LLMs through a single endpoint. Create custom knowledge bases or connect external data.
- In silico chemical library engine for high-accuracy chemical property prediction☆64May 2, 2025Updated last year
- ☆23Dec 1, 2019Updated 6 years ago
- Graph neural network for predicting NMR chemical shifts☆55May 6, 2022Updated 4 years ago
- Syntax highlighting for Orca input files in vim☆16Aug 29, 2022Updated 3 years ago
- Brent's code for FTIR deconvolution☆12Dec 17, 2020Updated 5 years ago
- colosseum system - open source fraction collector for laboratories☆28Mar 8, 2023Updated 3 years ago
- CAlculation of NMR Chemical Shifts using Deep LEarning☆70Mar 27, 2023Updated 3 years ago
- Accelerated molecular crystal structure determination from powder diffraction data☆13Jun 20, 2025Updated last year
- ☆20Aug 10, 2023Updated 2 years ago
- End-to-end encrypted cloud storage - Proton Drive • AdSpecial offer: 40% Off Yearly / 80% Off First Month. Protect your most important files, photos, and documents from prying eyes.
- Some shell scripts related to Thermo Fisher raw format conversion using msconvert☆15Feb 10, 2026Updated 4 months ago
- Python bindings to ObjCryst++ Object-Oriented Crystallographic Library☆18Jun 20, 2026Updated last week
- Smart Stirrer☆11Aug 17, 2020Updated 5 years ago
- predicting AlogP with machine or deep learning☆10Feb 28, 2021Updated 5 years ago
- A tool to convert IUPAC representations of glycans into SMILES strings.☆17Aug 19, 2025Updated 10 months ago
- Laser-Induced Break Down Spectroscopy spectra analysis software☆10Jul 30, 2019Updated 6 years ago
- DOSY processing☆10Mar 11, 2022Updated 4 years ago
- ☆33Jan 8, 2025Updated last year
- 💠 Nepxion Marvel is a meta-model framework based on ribbon desktop used for Comminications, Telecommunication, Mobiles☆12Aug 11, 2024Updated last year
- Deploy to Railway using AI coding agents - Free Credits Offer • AdUse Claude Code, Codex, OpenCode, and more. Autonomous software development now has the infrastructure to match with Railway.
- The backend services of the GenUI framework. The backend provides the REST API used for molecular generation, QSAR modelling and chemical…☆36Feb 3, 2026Updated 4 months ago
- Example scripts for the DiffPy-CMI complex modeling framework☆10Feb 12, 2024Updated 2 years ago
- Dashboard for LLM Drug Discovery Challenge.☆14Sep 6, 2023Updated 2 years ago
- DiffPy-CMI tutorial files for the ADD2019 workshop, ILL, Grenoble☆12Mar 25, 2019Updated 7 years ago
- Opensource software to model heterogeneous catalytic reactions. Based on Cantera☆19Jan 18, 2024Updated 2 years ago
- Text mining synthesis information in metal organic framework☆13Aug 25, 2021Updated 4 years ago
- ☆19Nov 25, 2025Updated 7 months ago