Trusted, Bureaucrats, Administrators
1,660
edits
Changes
:9@N cdp.mol[0].res[3].spin[0].theta
:10@N cdp.mol[0].res[4].spin[0].theta
</source>
You can then write out the values
<source lang="python">
value.write(param='theta', file='theta.out', dir="~", scaling=1.0, comment=None, bc=False, force=True)
</source>
== See also ==
[[Category:sample_scripts]]