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New, significantly improved, versions of shelxc and shelxe for Linux,
MacOSX and Windows and the documentation file fastphas.pdf (strongly
recommended reading for anyone planning to do experimental phasing with
these programs) are now available on my server. Registered SHELX users
who can remember the password may download them without further
formalities (otherwise please contact me). shelxe now includes the
notorious 'free lunch algorithm'. There are no expiry dates and the
complete SHELX is available as OPEN SOURCE.
I am not sure what to do about the executables for other operating
systems, for example my colleague who kindly allowed me to compile on
his SGI has now thrown it out. Maybe I should abandon SGI and Digital
UNIX, anyone who is still using them could easily compile the programs
themselves, e.g.
f95 shelxc.f -o shelxc
f95 shelxe.f -o shelxe
which does however require a Fortran-95 compiler (f90 would probably
also work). So my questions:
1. Is anyone still using SGI and Digital Unix systems (or indeed any
systems other than Linux, Windows and MacOSX)?
2. If so, are they willing and able to compile the programs themselves?
Happy New Year!
George
--
Prof. George M. Sheldrick FRS
Dept. Structural Chemistry,
University of Goettingen,
Tammannstr. 4,
D37077 Goettingen, Germany
Tel. +49-551-39-3021 or -3068
Fax. +49-551-39-2582
