Re: [COOT] including symmetry mates in sphere refinement

2016-12-19 Thread Andrea PICA
It would be very convenient indeed. Hope it will be scheduled at some point. Thanks, Andrea On 2016-12-19 11:38, Paul Emsley wrote: On 19/12/2016 08:44, Andrea PICA wrote: Hello everyone, I was wondering whether it would be possible in coot to include symmetry related atoms in sphere

Re: [COOT] including symmetry mates in sphere refinement

2016-12-19 Thread Paul Emsley
On 19/12/2016 08:44, Andrea PICA wrote: Hello everyone, I was wondering whether it would be possible in coot to include symmetry related atoms in sphere refinement. I've thought about it. It's tricky and probably slow. It's a nice feature to have, but not scheduled at the moment. Paul.

[COOT] including symmetry mates in sphere refinement

2016-12-19 Thread Andrea PICA
Hello everyone, I was wondering whether it would be possible in coot to include symmetry related atoms in sphere refinement. It would be great that upon refinement of residues close to a symmetry mate, the side chains would not end up in positions with severe clashes. Best, Andrea coot