Shelx on OS X

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SHELX is a set of programs for crystal structure determination from single-crystal diffraction data.


Return to Crystallography on OS X


Making OS X a viable Unix Platform

Installing X Windows

Installing Developer Tools

Installing Fink

OS X Unix Links

OS X Unix Advice Board


Crystallography Programs

Use Fink to Install Crystal Software

Installing CCP4

Installing CNS-1.2

Installing Solve

Installing Data Processing Software

Installing Eden

Installing Molecular Display Packages


Other Links of Interest

Various Useful OS X Programs

Backups

Screenshots

Biophysics on OS X

NMR on OS X

W. G. Scott Research Group


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Summary of my recommended installation:



1. Obtain a license and
download Shelx source code (unix.tgz).

2. Install ccp4 (and if you are using fink, be sure to install ccp4-dev).

3. Install gfortran

4. Issue the commands

tar xvfz unix.tgz
cd unix
wget http://sage.ucsc.edu/xtal/install_shelx.zsh
chmod a+x install_shelx.zsh
./install_shelx.zsh /usr/local/bin


(You can substitute any bin directory in your $PATH for /usr/local/bin.)

5. You might also want to get hkl2map and put it in your $PATH

6. I recommend using coot rather than xfit.  Coot reads foo.phs files produced by shelx.



Alternatively, you can just download the binary distribution for shelx.



The hkl2map TCLTK gui running in the OS X aqua environment.

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