I would like to understand the link below. I am not quite sure what each of those numbers mean, although the link does mention, can somebody clearly explain what those numbers are in restraints panel?
http://salilab.org/modeller/8v1/manual/node157.html#SECTION:atomid
Also, I would like to restrain N-N distance rather than C-alpha C-alpha. How do I make those changes?
Thanks a lot
Manju
On 02/05/2014 10:57 AM, Manjula Mummadisetti wrote: > I would like to understand the link below. I am not quite sure what each > of those numbers mean, although the link does mention, can somebody > clearly explain what those numbers are in restraints panel? > > http://salilab.org/modeller/8v1/manual/node157.html#SECTION:atomid
That's a very old version of the docs. Here's the latest: http://salilab.org/modeller/9.12/manual/node480.html
All the numbers are explained at that link. However, we don't generally recommend you add restraints by hand-writing raw restraints files; you can do it from Python instead. There is an example at http://salilab.org/modeller/9.12/manual/node27.html
> Also, I would like to restrain N-N distance rather than C-alpha C-alpha. > How do I make those changes?
It's exactly the same - the atom type doesn't matter.
Ben Webb, Modeller Caretaker