Klaus Eichele:
Available Software
(mostly NMR)
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Klaus Eichele:
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The following list gives some of the programs developed to deal with NMR spectra of solids. These programs are written in FORTRAN, C or C++ to run in an MS Windows environment. Most programs are 16 bit applications and run on Windows 3.1, 9x, and NT.
The programs can be obtained without cost. Some programs are directly downloadable. Other programs will be sent via email upon request. Several of the programs listed here are still maintained and developed further. Therefore, I would like to have some feedback as to bug reports, suggestions, environments the programs are used in (processor, operating system...), etc. and hence would ask users to submit a brief report addressing these issues.
DSR |
Implementation of the "Dipolar-Splitting Ratio Method"
for the analysis of dipolar-chemical shift spectra |
DXFIX |
A program to fix Bruker WinNMR or XWinNMR spectra exported in JCAMP-DX format. |
GETUXNMR |
WinSock application for file transfer (FTP) under Windows,
specifically designed for NMR files originating from Bruker XWinNMR or UXNMR |
HBA |
Perform analysis of spinning-sideband intensities using
the Herzfeld-Berger method. |
PAIN |
NMR file format converter |
R |
A Windows tool implementing a periodic system of elements,
table of nuclear properties, and a calculator for dipolar coupling constants. |
SOLIDS |
Simulation of solid-state NMR spectra, with input of
experimental spectra and generation of HPGL files. |
SpecMake |
The ultimate file conversion routine: converts scanned images to spectra compatible with Bruker's WinNMR |
SpecPlot |
A program to plot NMR spectra into an HPGL file |
Trafo |
Perform some simple transformations on fractional and Cartesian coordinates |
WSolids1 |
A new version of SOLIDS, running under Windows and implementing
the multiple document interface. The following programs are spin-offs,
which share libraries with WSolids1: HBA, SpecPlot, SpecMake, Trafo. |
[ Go Home ] | last modified: 30.07.2002