Yannick

This is pretty easy to fix if the rigid body contains at least three xyzs. Suppose their coordinates are stored in `o`, `x` and `y` then the following builds an...

the solution can be simplified using a single xyz: project its coordinates onto the z axis of the reference frame, and orient the reference frame so that particular projection always...

- yes let's drop the three-particle solution - sure. We can always warn that rigid bodies lose their reference frame if they are deformed. - uh, why is that? there's...

fyi I've written a couple of new classes related to this. Given the problems mentioned in this issue, I had to reimplement a representation for internal coordinates that was stabler...

first I should say that all I'm dealing with are translations of the centroid, and rigid body rotations, encoded as quaternions. The tunneler works as follows: You start by giving...

I should add that if you have a couple of basins separated by a large barrier that should help in jumping from one to another. I would have called it...

no, but since the mpi module expects to use mpirun for some usages, it would make sense to use the mpirun version IMP was compiled agains.t Le 06/03/14 20:05, drussel...