[gmx-users] gromacs for sp5 and g(r,theta)
acorrea at unisa.it
acorrea at unisa.it
Mon Jul 11 13:16:18 CEST 2005
Hallo,
I have two (maybe trivial) questions for the list:
1-
I would like to test gromacs on sp5 machine, somebody can help me: Have I to
download a special version of the program, install some particular library...
I tried to use the normal code but the results are not very encouraging.... I
thing that I am doing something of wrong.
And is somebody using gromacs on sp5?
2-
in chapter 8 of the manual (3.2) I read that with g_rdf it is also possible to
calculate an angle dependent r(r,theta) somebody can suggest me how I have to
set the axis respect to which I want to define theta?
Thanks in advance for any suggestion
and have a nice day to everybody
bye bye,
Andrea.
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