AFITT
Automatic LIgand Fitting to Crystallographic Density
BROOD
Fragment Replacement and Molecular Design
EON
Electrostatic Similarity for Lead-hopping
FILTER
Compound Property Calculation & Removal of Undesirables
OEDocking
Molecular Docking Tools and Workflows for Protein-ligand Interaction
OMEGA
Conformer Ensembles Containing Bioactive Conformations
pKa Prospector
Providing Protonation Insights for Novel Molecules
QUACPAC
Tautomer/Protomer Enumeration & Charge Assignment
ROCS
Shape Similarity for Virtual Screening & Lead Hopping
SPRUCE
Protein preparation and modeling
SZMAP/GamePlan
Water…Where it Matters, When it Matters
SZYBKI/FreeForm
Molecular Structure Optimization in situ with MMFF94
VIDA
Visualization & Communication of Modeling Results
