Hi,

I believe you should generate an index file (make_ndx) with the atoms you are interested in and run g_order.

Good luck,

/Carl


Dinesh Pinisetty wrote:
Hello Everyone,

I have a 50ns simulation which involves DMSO molecules. How do I find the orientation of DMSO molecules for the whole simulation. I know that water orientation can be found by using the command g_h2order. I tried using g_h2order for DMSO molecules orientation but I was not sure if that is right. I will greatful if anyone could suggest me the right command to be used.

Sincerely,

Dinesh.



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