flexres pdb export and sdf export bugfix#72

Merged

maylinnp merged 18 commits intoreleasefrom

May 22, 2025

Commits on Mar 27, 2025

Commits on Apr 15, 2025

bug fix: if just clustering without filtering could result in error
maylinnp
committed

Commits on Apr 30, 2025

improve speed for retrieving ligand info in large dbs
maylinnp
committed

Commits on May 1, 2025

checking to see if file and path are actual file and path, and if they exist, before queuing them up for multiprocessing
maylinnp
committed
Merge branch 'develop' of github.com:forlilab/Ringtail into develop
maylinnp
committed