Closed joaomcteixeira closed 2 years ago
Those lines provide anisotropy information - completely different from the ATOM recoords.
@JoaoRodrigues https://github.com/JoaoRodrigues to my understanding, ANISOU lines do not have information on the occ. Do they? If yes, where?
Perfect. As I expected. I will add a couple more of tests still.
Done. Additional tests and further improvements.
Some time ago, #117 improved
pdb_selaltloc
considerably. Still some cases referring to theANISOU
lines were not covered by the tests which resulted in some bugs -> #130.From #130, I noticed
pdb_selaltloc
was also not working properly with residueVU7
.Done in this PR:
ANISOU
linesVU7
(7K2U.pdb
) like cases found when exploring #130@JoaoRodrigues to my understanding,
ANISOU
lines do not have information on theocc
. Do they? If yes, where?Should be merged as
PATCH
.