Re: CCL:md rookie update



 Hi,
 If you aren't worried about loosing the last decimal of the accuracy you
 can use my small FORTRAN program for CHARMM trajectories for the
 formatting/unformatting at:
 http://laaksonen.csc.fi/gopenmol/distribute/linux/charmmtrj.f
 I mostly use the program to move the trajectories between different
 types of machines.
 Regards,
 -leif laaksonen
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 On Thu, 8 Jan 1998, Konrad Hinsen wrote:
 > > The dcd trajectory format is machine-dependant; there is a
 other-endian
 > > filter out there which I haven't been able to get to work, however.
 >
 > The Molecular Modelling Toolkit (MMTK), available at
 > http://starship.skyport.net/crew/hinsen/mmtk.html, allows
 conversion
 > of DCD files into machine-independent netCDF files. The inverse
 > conversion is not yet implemented, but MMTK contains plenty of
 > analysis functions to do whatever you want with the netCDF trajectory
 > files.
 > --
 >
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 > Konrad Hinsen                          | E-Mail: hinsen \\at// ibs.ibs.fr
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