Nathaniel Corley

icon indicating a website link www.natecorley.com icon indicating an email [email protected]

icon company @baker-laboratory icon location Seattle icon location PhD Candidate at the University of Washington's Institute for Protein Design | Baker Lab | Machine Learning for Protein Design | Enzymes

Results 2 issues of Nathaniel Corley

Determinism when resolving atom alternative locations

3 comment

### Problem description: In many mmCIF files, atoms exist equally in two locations, each with an occupancy of 0.5. For example, this screenshot from PDB ID `1adl`: ![image](https://github.com/biotite-dev/biotite/assets/8575391/ea0f24da-473f-4b62-9c9d-0ca0730d6789) Currently, when...

bug

fix: support alternative atom names within connect_via_residue_names

5 comment

Addresses https://github.com/biotite-dev/biotite/issues/684