Hi All
sorry for asking non-crystallography related question. Is it possible
to integrate crysol or FoxS in python and pymol? I have generated thousands of
models of my protein that I want to test against SAXS and other biochemical
data. The ability to integrate the comparison of experimental and calculated
X-ray scattering profile into python and pymol will be really helpful as I can
easily calculate other parameter of my protein in pymol and compare it to other
biochemical data. There is a pymol plugin available for SAXS but its not
helpful for me as its not practical to use plugins for so many different
models. I am looking for script that can automate the calculation.
if anyone has script that can do this and is willing to share with
me, that will be really helpful.
thank you
Dhiraj
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