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Search results for nmr
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28 search results found
Spectrochempy
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102
SpectroChemPy is a framework for processing, analyzing and modeling spectroscopic data for chemistry with Python
Openchrom
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72
Visualization and Analysis of mass spectrometric and chromatographic data.
Irtools
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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.
Chemospec
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47
R functions for the chemometric analysis of spectra
Nmrium
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44
React component to display and process nuclear magnetic resonance (NMR) spectra.
Mrsimulator
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30
A fast solid-state NMR spectrum simulation and analysis library.
Qe Gipaw
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28
QE-GIPAW for Quantum-Espresso (official repository)
Chemex
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25
ChemEx is an analysis program for chemical exchange detected by NMR.
Tools Metabolomics
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21
Galaxy tools for metabolomics maintained by Workflow4Metabolomics
Nmrsim
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19
A Python library for NMR simulation
Nmrformd
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16
NMRforMD is a python script for the calculation of NMR relaxation time T1 and T2 from molecular dynamics trajectory file.
Metarbolomics Book
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15
The MetaRbolomics book. A review of R packages in BioC, CRAN, gitlab and github.
Foss4spectroscopy
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14
FOSS Resources for Spectroscopy
Spike
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11
SPIKE a collaborative development for a FT-spectroscopy processing program.
Nmrxiv
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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.
Chemsharp
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10
Library for processing of chemistry related files (aiming at spectroscopy and structural files)
Hyperspec
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10
hyperSpec: Tools for Spectroscopy
Bioen
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9
BioEn - Bayesian Inference Of ENsembles
Farseer Nmr
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9
A software suite for automatic treatment, analysis and plotting of large and multivariable datasets of bioNMR peaklists.
Madbyte
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8
Metabolomics And Dereplication By Two-dimensional Experiments - MADByTE NMR Metabolomics Platform
Workflow4metabolomics
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8
Workflow4Metabolomics meta repository
Synthetic_well Log_polynomial_regression
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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.
Dnplab
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6
DNPLab - Bringing the power of Python to DNP-NMR Spectroscopy
Pycoilgen
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6
Magnetic Field Coil Generator for Python, ported from CoilGen
Soprano
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6
Soprano - a Python library to crack crystals!
Penguins
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5
A Python 3 package for analysing and plotting NMR spectra.
Nmr Parser
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5
read and convert any NMR file
Consensx.itk.ppke.hu
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5
CoNSEnsX - Complience of NMR-derived Structural Ensembles with Experimental Data
Related Searches
Python Nmr (24)
Spectroscopy Nmr (10)
R Nmr (8)
Jupyter Notebook Nmr (7)
1-28 of 28 search results
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