Alexander Rose
Alexander Rose
Can you share an example file/residue? The bond order assignment depends on specific atoms names (as used in PDB archive and various xtal software). If you deviate from that and...
any takers?
> When we use the camera reset instead, does it perform an exact computation under the hood? No, that is based on the bounding sphere assigned to the renderables. For...
> When we use the camera reset instead, does it perform an exact computation under the hood? Also, the "exact" computation is not necessarily better. All bounding sphere computations are...
> In the first case, the view is not perfectly centered on the structure. Can you share an example? Maybe there are edge cases we can improve upon?
> When I use `structure.lookup3d.boundary.sphere.center` to center the structure in the viewport, I get a different result than when using `ElementLoci.getBoundary(ElementLoci.all(structure)).sphere.center`. We can consider to check if `ElementLoci.getBoundary` is called...
Can you share the PDB? Does it load in molstar.org/viewer? Can you do a minimal example in CodeSandbox like https://github.com/molstar/example-gallery?
@sbittrich got any other ideas in the meanwhile?
Thanks!