[gmx-users] structure factor

Alexander Malafeev malafeev.a at gmail.com
Mon Feb 23 12:39:08 CET 2009


Hello, I try to calculate structure factor for coarse-grained system with
g_rdf, but I get error

> Fatal error:
>
> Error: atom (B1) not in list (5 types checked)!

It is possible to calculate structure factor for coarse-grained model with
g_rdf? And how I can do it?
Thanks in advance.
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