Software



Search Headquarters : Science : Chemistry : Nuclear Magnetic Resonance : Software
  • Prediction Software (10)
  • Processing Software (12)
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  • Simulation Software (8)
  • Spectrometer Operation (4)
  • Structure Calculation Software (7)

  • 21 pages found in Software:

    Ad Bax Group and NIH
    TALOS Program, NMRPipe, SSIA, and PALES software. Articles with contact information.
    http://spin.niddk.nih.gov/bax/software/

    Advanced Chemistry Development
    Provides a wide set of desktop and on-line software for chemists and educators: NMR, IR, UV, MS, drawing and modelling, chromatography, naming, comprehensive databases and predictions.
    http://www.acdlabs.com/

    Babel - A Molecular Structure Information Interchange Hub
    A program designed to interconvert a number of file formats currently used in molecular modeling.
    http://smog.com/chem/babel/

    Chemical shift (J) to Dihedral angle converter
    This is a web-based program that converts the chemical shift from NMR spectra to the dihedral (torsional) angle to assist in molecular modelling which uses the Karplus equations to perform the calculations.
    http://www.jonathanpmiller.com/Karplus.html

    Dmfit and EditNMR Programs
    The Dmfit programs enables fitting of solid state (and liquid) NMR spectra, including 1D and 2D datasets. Edit NMR program : file Viewer for NMR files.
    http://crmht-europe.cnrs-orleans.fr/dmfit/

    GAMMA
    C++ library for simulation of Magnetic Resonance experiments.
    http://gamma.ethz.ch/

    IBS: LRMN Software Developments
    Software: CURVE3D, visualisation of 3D surface. TENSOR, determination of the rotational diffusion tensor
    http://www.ibs.fr/ext/labos/LRMN/softs/welcome.htm

    IUNMR Software
    Software developed for NMR at IU
    http://nmr.chem.indiana.edu/software.html

    Linux4Chemistry
    Linux software for chemistry: molecular modeling, visualization, graphics, quantum mechanics, dynamics, kinetics, simulations, NMR Structure elucidation.
    http://www.redbrick.dcu.ie/~noel/linux4chemistry/

    Mathcad
    Documents for Teaching NMR
    http://science.widener.edu/svb/nmr/mcad_nmr.html

    NMR pipe
    A very easy to use NMR data processing software package.
    http://spin.niddk.nih.gov/bax/software/NMRPipe/

    NMR software
    CALM is a DOS-based program for iterative analysis of high resolution NMR-spectra. And Coder 7 is a universal multi format NMR data converter. Handles both FIDs and spectra.
    http://nmrl.ioc.ac.ru/software.htm

    NMR Software list
    A large and useful list of NMR software, processing, assignment, and simulation. From University of Potsdam.
    http://www.chem.uni-potsdam.de/linkcenter/nmrsoft.html

    Quantitative NMR
    A group offering a software package and method of analysis that puports to give quantitative and qualitative information . Methodology is called qNMR.
    http://tigger.uic.edu/~gfp/qnmr/

    relax
    A program for analyzing NMR data for the study of the dynamics of proteins and other macromolecules.
    http://nmr-relax.com

    Roland Stenutz's Homepage
    A few nice Karplus and Pachler calculators. Downloadable
    http://www.stenutz.eu/conf/jhh.html

    Software by Klaus Eichele
    Several useful and important packages for NMR, simulation, JCAMP data repair, GETUXNMR, SpecMake and SpecPlot.
    http://anorganik.uni-tuebingen.de/klaus/soft/index.php

    Software packages developed at the CMRR
    Stimulate - multifunctional image analysis tool, PhysioFix - adjust for respiration and cardio effects, PhysioFix for Matlab, Cluster_prob - clustered pixel probability, Sarcalc - energy used by your pulse sequence, MTM - Multi-Taper Methods for signal/noise analysis, FAST MAP - magnet shimming tool, NMR Kitchen - software based on product operator calculation
    http://www.cmrr.umn.edu/downloads/index.shtml

    SPSCAN
    SPSCAN supports semi-automatic assignment of NMR spectra of biological macromolecules. The program is written in C++ for UNIX computers with X-Window interface.
    http://www.personal.uni-jena.de/~b1glra/spscan/manual/

    VINCE
    A Program for Displaying Protein NOE Data
    http://www.rowland.org/rnmrtk/vince.html

    Wuthrich group NMR software
    A list of various software packages including: ATNOS, AUTOPSY, GARANT, MOUMOL, RADAR, and XEASY
    http://www.mol.biol.ethz.ch/groups/wuthrich_group/software


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