A Python module for processing NMR spectra.
☆38Mar 20, 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 3 months ago
- A module for working with NMR data in Python☆266Feb 9, 2026Updated 4 months ago
- ☆13Nov 5, 2020Updated 5 years 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
- Automated spectraL Processing System for NMR☆16Sep 24, 2025Updated 8 months ago
- 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.
- Neural Message Passing for NMR Chemical Shift Prediction☆11Aug 10, 2022Updated 3 years ago
- Python module for parsing, writing, aligning, and manipulating glycan structrures☆10Apr 16, 2026Updated last month
- A fast solid-state NMR spectrum simulation and analysis library.☆46Dec 15, 2025Updated 5 months ago
- Soprano - a Python library to crack crystals!☆12May 20, 2026Updated 2 weeks ago
- Prediction molecular structure from NMR spectra☆47Mar 19, 2024Updated 2 years ago
- Flowchem is an application to simplify the control of instruments and devices commonly found in chemistry labs.☆21May 15, 2026Updated 3 weeks ago
- A Python library for NMR simulation☆29Jan 15, 2024Updated 2 years ago
- 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
- Open source password manager - Proton Pass • AdSecurely store, share, and autofill your credentials with Proton Pass, the end-to-end encrypted password manager trusted by millions.
- A program for the analysis of NMR data.☆29Jun 23, 2024Updated last year
- 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☆67Mar 27, 2023Updated 3 years ago
- Accelerated molecular crystal structure determination from powder diffraction data☆13Jun 20, 2025Updated 11 months ago
- 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.
- Genarris is a random molecular crystal structure generator.☆31May 26, 2026Updated 2 weeks ago
- ☆20Aug 10, 2023Updated 2 years ago
- Some shell scripts related to Thermo Fisher raw format conversion using msconvert☆15Feb 10, 2026Updated 3 months ago
- Python bindings to ObjCryst++ Object-Oriented Crystallographic Library☆18Apr 6, 2026Updated 2 months 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 9 months ago
- Python package for analysing the results of tensile tests☆10Jan 14, 2021Updated 5 years ago
- Laser-Induced Break Down Spectroscopy spectra analysis software☆10Jul 30, 2019Updated 6 years ago
- DOSY processing☆10Mar 11, 2022Updated 4 years ago
- Wordpress hosting with auto-scaling - Free Trial Offer • AdFully Managed hosting for WordPress and WooCommerce businesses that need reliable, auto-scalable performance. Cloudways SafeUpdates now available.
- ☆33Jan 8, 2025Updated last year
- Global Spectra Deconvolution + Peak optimizer☆14Jun 2, 2026Updated last 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
- 💠 Nepxion Marvel is a meta-model framework based on ribbon desktop used for Comminications, Telecommunication, Mobiles☆12Aug 11, 2024Updated last year
- A set of Python utilities for reading JCAMP-DX files.☆61Apr 5, 2026Updated 2 months ago
- 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