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The Top 23 Nmr Open Source Projects

Open source projects categorized as Nmr
Categories > Nmr
Spectrochempy ⭐ 102
SpectroChemPy is a framework for processing, analyzing and modeling spectroscopic data for chemistry with Python
most recent commit 5 months ago
Openchrom ⭐ 72
Visualization and Analysis of mass spectrometric and chromatographic data.
most recent commit 5 months ago
Irtools ⭐ 55
MATLAB package of iterative regularization methods and large-scale test problems. This software is described in the paper "IR Tools: A MATLAB Package of Iterative Regularization Methods and Large-Scale Test Problems" that will be published in Numerical Algorithms, 2018.
most recent commit 2 years ago
Chemospec ⭐ 47
R functions for the chemometric analysis of spectra
dependent packages 4total releases 42most recent commit a year ago
Nmrium ⭐ 44
React component to display and process nuclear magnetic resonance (NMR) spectra.
dependent packages 3total releases 61most recent commit 5 months agonpm nmrium} Downloads
Mrsimulator ⭐ 30
A fast solid-state NMR spectrum simulation and analysis library.
dependent packages 1total releases 19most recent commit 2 months agopypi mrsimulator} Downloads
Qe Gipaw ⭐ 28
QE-GIPAW for Quantum-Espresso (official repository)
most recent commit 6 months ago
Chemex ⭐ 25
ChemEx is an analysis program for chemical exchange detected by NMR.
total releases 21most recent commit 5 months ago
Tools Metabolomics ⭐ 21
Galaxy tools for metabolomics maintained by Workflow4Metabolomics
most recent commit 5 months ago
Nmrsim ⭐ 19
A Python library for NMR simulation
most recent commit 7 months ago
Nmrformd ⭐ 16
NMRforMD is a python script for the calculation of NMR relaxation time T1 and T2 from molecular dynamics trajectory file.
total releases 9most recent commit 5 months ago
Metarbolomics Book ⭐ 15
The MetaRbolomics book. A review of R packages in BioC, CRAN, gitlab and github.
most recent commit 3 years ago
Foss4spectroscopy ⭐ 14
FOSS Resources for Spectroscopy
most recent commit 10 months ago
Spike ⭐ 11
SPIKE a collaborative development for a FT-spectroscopy processing program.
most recent commit 8 months ago
Nmrxiv ⭐ 10
nmrXiv is currently developed as the FAIR, consensus-driven NMR data repository and computational platform. The ultimate goal is to accelerate broader coordination and data sharing among natural product (NP) researchers by enabling storage, management, sharing and analysis of NMR data.
most recent commit 5 months ago
Chemsharp ⭐ 10
Library for processing of chemistry related files (aiming at spectroscopy and structural files)
dependent packages 3total releases 38most recent commit 9 months agonuget ChemSharp} Downloads
Hyperspec ⭐ 10
hyperSpec: Tools for Spectroscopy
dependent packages 8total releases 17most recent commit 9 months ago
Bioen ⭐ 9
BioEn - Bayesian Inference Of ENsembles
most recent commit 2 years ago
Farseer Nmr ⭐ 9
A software suite for automatic treatment, analysis and plotting of large and multivariable datasets of bioNMR peaklists.
total releases 1most recent commit 4 years ago
Madbyte ⭐ 8
Metabolomics And Dereplication By Two-dimensional Experiments - MADByTE NMR Metabolomics Platform
most recent commit 5 months ago
Workflow4metabolomics ⭐ 8
Workflow4Metabolomics meta repository
most recent commit 3 years ago
Synthetic_well Log_polynomial_regression ⭐ 8
This project attempts to construct a missing well log from other available well logs, more specifically an NMR well log from the measured Gamma Ray (GR), Caliper, Resistivity logs and the interpreted porosity from a well.
most recent commit 4 years ago
Dnplab ⭐ 6
DNPLab - Bringing the power of Python to DNP-NMR Spectroscopy
dependent packages 1total releases 47most recent commit 5 months agopypi dnplab} Downloads
The 7 Most Depended On Nmr Open Source Projects
Hyperspec ⭐ 10
hyperSpec: Tools for Spectroscopy
dependent packages 8total releases 17latest release September 13, 2021most recent commit 9 months ago
Chemospec ⭐ 47
R functions for the chemometric analysis of spectra
dependent packages 4total releases 42latest release June 07, 2023most recent commit a year ago
Soprano ⭐ 6
Soprano - a Python library to crack crystals!
dependent packages 3total releases 18latest release November 03, 2021most recent commit a year agopypi Soprano} Downloads
Nmrium ⭐ 44
React component to display and process nuclear magnetic resonance (NMR) spectra.
dependent packages 3total releases 61latest release November 30, 2023most recent commit 5 months agonpm nmrium} Downloads
Chemsharp ⭐ 10
Library for processing of chemistry related files (aiming at spectroscopy and structural files)
dependent packages 3total releases 38latest release July 31, 2023most recent commit 9 months agonuget ChemSharp} Downloads
Mrsimulator ⭐ 30
A fast solid-state NMR spectrum simulation and analysis library.
dependent packages 1total releases 19latest release July 24, 2022most recent commit 2 months agopypi mrsimulator} Downloads
Dnplab ⭐ 6
DNPLab - Bringing the power of Python to DNP-NMR Spectroscopy
dependent packages 1total releases 47latest release January 05, 2024most recent commit 5 months agopypi dnplab} Downloads
The 10 Latest Releases In Nmr Open Source Projects
Dnplab ⭐ 6
DNPLab - Bringing the power of Python to DNP-NMR Spectroscopy
dependent packages 1total releases 47latest release January 05, 2024most recent commit 5 months agopypi dnplab} Downloads
Nmrium ⭐ 44
React component to display and process nuclear magnetic resonance (NMR) spectra.
dependent packages 3total releases 61latest release November 30, 2023most recent commit 5 months agonpm nmrium} Downloads
Chemex ⭐ 25
ChemEx is an analysis program for chemical exchange detected by NMR.
total releases 21latest release August 29, 2023most recent commit 5 months ago
Chemsharp ⭐ 10
Library for processing of chemistry related files (aiming at spectroscopy and structural files)
dependent packages 3total releases 38latest release July 31, 2023most recent commit 9 months agonuget ChemSharp} Downloads
Chemospec ⭐ 47
R functions for the chemometric analysis of spectra
dependent packages 4total releases 42latest release June 07, 2023most recent commit a year ago
Penguins ⭐ 5
A Python 3 package for analysing and plotting NMR spectra.
total releases 11latest release July 29, 2022most recent commit 9 months ago
Mrsimulator ⭐ 30
A fast solid-state NMR spectrum simulation and analysis library.
dependent packages 1total releases 19latest release July 24, 2022most recent commit 2 months agopypi mrsimulator} Downloads
Soprano ⭐ 6
Soprano - a Python library to crack crystals!
dependent packages 3total releases 18latest release November 03, 2021most recent commit a year agopypi Soprano} Downloads
Hyperspec ⭐ 10
hyperSpec: Tools for Spectroscopy
dependent packages 8total releases 17latest release September 13, 2021most recent commit 9 months ago
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