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NMR spectroscopy software tools

NMR spectroscopy applications

Most recent bioinformatics tools

ICM
Algorithm

ICM Internal Coordinate Modeling

Allows users to resolve problems bound to structure prediction of peptides,…

Allows users to resolve problems bound to structure prediction of peptides, molecular modeling and design. ICM is a complete internal coordinate system useful for treatment of bond angle and phase…

G T A T C G C T A
nmrglue
Desktop

nmrglue

Allows users to handle multidimensional nuclear magnetic resonance (NMR) data.…

Allows users to handle multidimensional nuclear magnetic resonance (NMR) data. Nmrglue is a module whose main functions are reading, writing, and interacting with spectral data from multiple commons…

PepsNMR
Desktop

PepsNMR

Offers a way for Proton Nuclear Magnetic Resonance (1H-NMR) data pre-treatment.…

Offers a way for Proton Nuclear Magnetic Resonance (1H-NMR) data pre-treatment. PepsNMR is a R package that supplies multiple features such as authorizing to read the free induction decay (FID)…

GRASS
Web

GRASS Generation, Ranking and Assignment of Saccharide Structures

Automates elucidation of regular poly- and oligomeric carbohydrate structures.…

Automates elucidation of regular poly- and oligomeric carbohydrate structures. GRASS employs a fast nuclear magnetic resonance (NMR) simulation method for rough ranking against the experimental NMR…

Most popular analytical software

Metabolab
Desktop

Metabolab

Facilitates Nuclear Magnetic Resonance (NMR) data processing by providing…

Facilitates Nuclear Magnetic Resonance (NMR) data processing by providing automated algorithms for processing series of spectra in a reproducible fashion. MetaboLab provides an intuitive software for…

CAVER
Desktop

CAVER

Provides rapid, accurate and fully automated calculation of tunnels and…

Provides rapid, accurate and fully automated calculation of tunnels and channels in static structures. The molecules amendable to analysis of CAVER include proteins, nucleic acids or inorganic…

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