Filter descriptors from noise and irrelevant information

1) Choose filtering accuracy/speed

Number of descriptor subsets to evaluate (smaller = faster)


2) Choose descriptor dataset *

From DDB From file (.zip, help)


3) Select descriptor types *

NNSCORE LIGSCORE DPOCKET RFSCORE
SMINA AUTODOCK41 PADEL ECFP
REPAST RETEST DSX* GOLD
CYSCORE XSCORE AFFISCORE CHEMGAUSS

*The last six descriptor types are disabled due to licensing restrictions.

4) Filtering results and files

Email results to * Make data public? Yes, share the knowledge
Save in DDB under name Description