AMBER Archive (2002)

Subject: again about sander_classic Amber 6.0

From: Nikolai Smolin (smolin_at_steak.chemie.uni-dortmund.de)
Date: Wed May 22 2002 - 06:42:50 CDT

  Dear Amber users,

    Thanks to all for helps with saving of *.mdcrd.
I setted ntwxm=0 and got my trajectory.
But now I have same problem with *.mdvel.
I set
    ntwv=100, ntwvm=0,
    ntwx=100, ntwxm=0,
    ntwe=100, ntwem=0,
And after simulation I have *.mdcrd and *.mden with all information
about trajectory and energy, but emty *.mdvel.

Any suggestion
thanks in advance! 

-- 
Dipl.-Phys. Nikolai Smolin

Physikalische Chemie I
Universitaet Dortmund
Otto-Hahn-Str. 6
44221 Dortmund
Germany

Tel:     +49 / 231 / 755 3929
Fax:     +49 / 231 / 755 3901

E-mail:  smolin_at_steak.chemie.uni-dortmund.de