Jonathan King

kabsch alignment algorithm swapped mobile and fixed when creating rotation matrix

2

Hello, I'm working on some code that suggests that when creating the rotation matrix via `superimpose`, the kabsch algorithm implementation simply has `fixed` and `mobile` swapped as in `superimpose.py:_superimpose()`. Do...

Larger HTML files not loading in any browser

2

Hi, Thanks for providing and supporting this great tool. I really enjoy the HTML feature. However, it seems like if the file gets too large or complex, it just won't...

micromamba support for chem_data

3

To install the `chem_data`, it is suggested to do `conda install `. This command doesn't work with `micromamba`. I see that `chem_data` is generated from other repos like https://gitlab.com/phenix_project/chem_data. Do...