You signed in with another tab or window. Reload to refresh your session.You signed out in another tab or window. Reload to refresh your session.You switched accounts on another tab or window. Reload to refresh your session.Dismiss alert
Normally, we are using the PDB file in connection with the PSF file, which contains all of the connectivity information. To put connectivity information in a PDB file is, therefore, redundant.
Bug summary
When trying to save to a PDB file, it returns a file without bonds.
Code to reproduce the behavior
Please include a code snippet that can be used to reproduce this bug.
The previous command yields (converted to txt for attachment):
hexane.txt
But the following is expected (converted to txt for attachment):
hexane1.txt
Software versions
python --version
)? 3.11.0The text was updated successfully, but these errors were encountered: