A Python module for processing NMR spectra.
☆40Jun 25, 2026Updated 2 months ago
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 6 months ago
- Analyzing thin-layer chromatography (TLC) chromatograms☆18May 6, 2024Updated 2 years ago
- A module for working with NMR data in Python☆272Aug 16, 2026Updated last week
- React component to display and process nuclear magnetic resonance (NMR) spectra.☆80Updated this week
- Small angle scattering tools ... but unlike most others, free.☆12Jul 7, 2026Updated last month
- 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.
- Prediction molecular structure from NMR spectra☆48Mar 19, 2024Updated 2 years ago
- Automated spectraL Processing System for NMR☆17Updated this week
- 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
- Soprano - a Python library to crack crystals!☆12Aug 11, 2026Updated 2 weeks ago
- A fast solid-state NMR spectrum simulation and analysis library.☆47Updated this week
- A spin dynamics simulation package that covers the whole of magnetic resonance spectroscopy and imaging.☆38Updated this week
- ☆18Sep 4, 2022Updated 3 years ago
- Brent's code for FTIR deconvolution☆12Dec 17, 2020Updated 5 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
- 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.
- code for "Automated and Intelligent Synthesis of Oxygen-Producing Catalysts from Martian Meteorites by Robotic AI-Chemist "☆12Jul 31, 2023Updated 3 years ago
- In silico chemical library engine for high-accuracy chemical property prediction☆64May 2, 2025Updated last year
- A program for the analysis of NMR data.☆31Jun 23, 2024Updated 2 years ago
- Graph neural network for predicting NMR chemical shifts☆55May 6, 2022Updated 4 years ago
- ☆19Aug 10, 2023Updated 3 years ago
- colosseum system - open source fraction collector for laboratories☆31Mar 8, 2023Updated 3 years ago
- CAlculation of NMR Chemical Shifts using Deep LEarning☆72Mar 27, 2023Updated 3 years ago
- Python package for analysing the results of tensile tests☆10Jan 14, 2021Updated 5 years ago
- Flowchem is an application to simplify the control of instruments and devices commonly found in chemistry labs.☆22Updated this week
- End-to-end encrypted email - Proton Mail • AdSpecial offer: 40% Off Yearly / 80% Off First Month. All Proton services are open source and independently audited for security.
- A comprehensive computational pipeline that bridges single-cell genomics and cheminformatics to accelerate Alzheimer's Disease research. …☆11Jul 13, 2025Updated last year
- Python bindings to ObjCryst++ Object-Oriented Crystallographic Library☆18Updated this week
- NMRforMD is a python script for the calculation of NMR relaxation time T1 and T2 from molecular dynamics trajectory file.☆25May 3, 2025Updated last year
- Code and data in support of the research paper about robotized exploration of organic reaction spaces☆16Sep 26, 2025Updated 11 months ago
- predicting AlogP with machine or deep learning☆10Feb 28, 2021Updated 5 years ago
- DOSY processing☆11Mar 11, 2022Updated 4 years ago
- 💠 Nepxion Marvel is a meta-model framework based on ribbon desktop used for Comminications, Telecommunication, Mobiles☆12Aug 11, 2024Updated 2 years ago
- Some shell scripts related to Thermo Fisher raw format conversion using msconvert☆15Feb 10, 2026Updated 6 months ago
- Global Spectra Deconvolution + Peak optimizer☆15Aug 3, 2026Updated 3 weeks ago
- GPU virtual machines on DigitalOcean Gradient AI • AdGet to production fast with high-performance AMD and NVIDIA GPUs you can spin up in seconds. The definition of operational simplicity.
- Dashboard for LLM Drug Discovery Challenge.☆14Sep 6, 2023Updated 2 years ago
- A collection of spectral collocation differentiation matrices☆12Jul 11, 2025Updated last year
- DiffPy-CMI tutorial files for the ADD2019 workshop, ILL, Grenoble☆12Mar 25, 2019Updated 7 years ago
- This repository contains organizational notes and details for the CECAM MADICES workshop, 7th-9th February 2022.☆13Feb 22, 2022Updated 4 years ago
- FOSS Resources for Spectroscopy☆21Nov 25, 2025Updated 9 months ago
- WebThings framework.☆21Nov 25, 2022Updated 3 years ago
- Suite of tools for noise analysis in Python☆17Sep 8, 2024Updated last year