Maximum number of restraints
![](https://secure.gravatar.com/avatar/76f79792a1d4247509dda348d6372559.jpg?s=120&d=mm&r=g)
Hi,
is it possible to set a maximum number of restraints to a particle?
Thanks, Davide
![](https://secure.gravatar.com/avatar/1294d100c1f5fcd24f7ba4dc0349cfac.jpg?s=120&d=mm&r=g)
Probably not, but what do you mean by that? What would happen when the maximum is exceeded?
On Nov 28, 2011, at 4:14 AM, Davide Baù wrote:
> Hi, > > is it possible to set a maximum number of restraints to a particle? > > Thanks, > Davide > _______________________________________________ > IMP-dev mailing list > IMP-dev@salilab.org > https://salilab.org/mailman/listinfo/imp-dev
![](https://secure.gravatar.com/avatar/76f79792a1d4247509dda348d6372559.jpg?s=120&d=mm&r=g)
What I meant is if there's away of defining the maximum number of connected particles, i.e., if I define a set of restraint via the MinimumPairRestraint, can I set a limit to the number of particles that can be connected?
On Nov 28, 2011, at 4:39 PM, Daniel Russel wrote:
> Probably not, but what do you mean by that? What would happen when the maximum is exceeded? > > > On Nov 28, 2011, at 4:14 AM, Davide Baù wrote: > >> Hi, >> >> is it possible to set a maximum number of restraints to a particle? >> >> Thanks, >> Davide >> _______________________________________________ >> IMP-dev mailing list >> IMP-dev@salilab.org >> https://salilab.org/mailman/listinfo/imp-dev > > > _______________________________________________ > IMP-dev mailing list > IMP-dev@salilab.org > https://salilab.org/mailman/listinfo/imp-dev
![](https://secure.gravatar.com/avatar/1294d100c1f5fcd24f7ba4dc0349cfac.jpg?s=120&d=mm&r=g)
Just so I am clear, you would like to score based on something like - the minimum k harmonic distance restraints chosen from a set of n possible distance restraints such that at most m particles are involved?
If so, we don't have support for it now. What is the motivation for such a scoring function?
On Mon, Nov 28, 2011 at 7:46 AM, Davide Baù davide.bau@gmail.com wrote:
> What I meant is if there's away of defining the maximum number of > connected particles, i.e., if I define a set of restraint via the > MinimumPairRestraint, can I set a limit to the number of particles that can > be connected? > > > On Nov 28, 2011, at 4:39 PM, Daniel Russel wrote: > > > Probably not, but what do you mean by that? What would happen when the > maximum is exceeded? > > > > > > On Nov 28, 2011, at 4:14 AM, Davide Baů wrote: > > > >> Hi, > >> > >> is it possible to set a maximum number of restraints to a particle? > >> > >> Thanks, > >> Davide > >> _______________________________________________ > >> IMP-dev mailing list > >> IMP-dev@salilab.org > >> https://salilab.org/mailman/listinfo/imp-dev > > > > > > _______________________________________________ > > IMP-dev mailing list > > IMP-dev@salilab.org > > https://salilab.org/mailman/listinfo/imp-dev > > > _______________________________________________ > IMP-dev mailing list > IMP-dev@salilab.org > https://salilab.org/mailman/listinfo/imp-dev >
![](https://secure.gravatar.com/avatar/76f79792a1d4247509dda348d6372559.jpg?s=120&d=mm&r=g)
Suppose we have two particles, A and B, which are connected to n other particles. To select the connected pairs, I use the MinimumPairRestraint function. This works fine because the n other particles can be connected to both A and B, with a certain preference depending on the size of A and B. The problem is that doing so I end up with all the n particles connected only to A (or only to B), and I know that there is a "saturation" limit, i.e. A and B can be connected to a maximum number of particles. That's why I would like to limit the maximum number of particles that can be connected to A and to B.
On Nov 28, 2011, at 7:51 PM, Daniel Russel wrote:
> Just so I am clear, you would like to score based on something like > - the minimum k harmonic distance restraints chosen from a set of n possible distance restraints such that at most m particles are involved? > > If so, we don't have support for it now. What is the motivation for such a scoring function? > > On Mon, Nov 28, 2011 at 7:46 AM, Davide Baù davide.bau@gmail.com wrote: > What I meant is if there's away of defining the maximum number of connected particles, i.e., if I define a set of restraint via the MinimumPairRestraint, can I set a limit to the number of particles that can be connected? > > > On Nov 28, 2011, at 4:39 PM, Daniel Russel wrote: > > > Probably not, but what do you mean by that? What would happen when the maximum is exceeded? > > > > > > On Nov 28, 2011, at 4:14 AM, Davide Baů wrote: > > > >> Hi, > >> > >> is it possible to set a maximum number of restraints to a particle? > >> > >> Thanks, > >> Davide > >> _______________________________________________ > >> IMP-dev mailing list > >> IMP-dev@salilab.org > >> https://salilab.org/mailman/listinfo/imp-dev > > > > > > _______________________________________________ > > IMP-dev mailing list > > IMP-dev@salilab.org > > https://salilab.org/mailman/listinfo/imp-dev > > > _______________________________________________ > IMP-dev mailing list > IMP-dev@salilab.org > https://salilab.org/mailman/listinfo/imp-dev > > _______________________________________________ > IMP-dev mailing list > IMP-dev@salilab.org > https://salilab.org/mailman/listinfo/imp-dev
participants (2)
-
Daniel Russel
-
Davide Baù