On 4/30/12 11:41 AM, Lara Bunte wrote:
Hi

I have the command


trjconv -n index.ndx -f molecule.pdb -o output.pdb


that don't work because of the missing topol.tpr file. You wrote:

Supply your .pdb file to the -s flag

Where exactly do I have to write -s in my command?



Anywhere.  Order of arguments is irrelevant to all Gromacs commands.

-Justin

--
========================================

Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
MILES-IGERT Trainee
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin

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