The following sub-topics provide a summary of structure-based calculations:
Charge in JChem for Office
Drug Discovery Filtering
Elemental Analysis
Geometry in JChem for Office
Hydrogen Bond Donor-Acceptor
Isomers in JChem for Office
IUPAC Naming
Markush Enumeration in JChem for Office
Protonation and Partitioning
Structure
Tautomers in JChem for Office
Topology Analysis