Chem & Bio Features
- MACCS, Questel/Chempath, CAS, RS3, ISIS/Base and ISIS/Draw compatible
- Atom label expansion
- Drag and drop structures between application and documents
- Query chemical databases
- Multi -Center attachments for organometallics
- Define complex database queries by spescifying free sites, reaction centers, substituent counts, R groups and substructure list
- Chemical intelligence - finds errors and computes properties
- Color drawing and output
- Draw structural formulas and reactions
- Pre-defined structure templates
- Compatible with other CS products, MS Word, WordPerfect, Excel
- Numerous styles of bonds, arrows, brackets, boxes, orbitals and reaction mechanism symbols
- Style templates for most chemistry journals
- Output in PostScript, EPS, GIF, SMILES and more
CS ChemFinder Ultra 9.0 - Searching and Information Integration
- Advanced search and structure query features
- Completely integrated with ChemDraw and Chem3D
- Store structures and models for easy retrieval
- WWW Chemical Information Server included
- Annotate compounds with test results, notes, etc.
- Soft by formula, molecular weight or any text or number field
- Display detailed information by compound
- Fully relational database engine
- Manages 100 of 1000 of compounds
- Simple, user-definable forms for custom displays
- High performance substructure searching
- Compound perception and search algorithms
CS Chem3D Ultra 9.0 - Molecular Modeling and Analysis
- Model types: space filling (CPK), cylindrical bonds, stick, ball and stick, ribbons and write-frame
- Display options: van der Waals dot surfaces and single-point light source color shading
- Create 3D models from ChemDraw or ISIS/Draw
- Polypetide builder and residue recognition
- Supports: PDB, MacroModel, MDL MOLFILE, CAS via SMD, Beilstein ROSDAL, Tripos SYBYL MOL and MOL2, Cambridge Structural Database, MOPAC, EPS, PICT, GIF and more
- MM2 mM. and molecular dynamics
- Dock ligand and substrate molecules
- Interactive Simulations and molecular modeling
- Princeton simulations' Conformer for conformational analysis from within Chem3D
- Calculate Hf, solvation energy, dipoles, charges, UHF and RHF spin densities
CS ChemInfo Pro 9.0- Structures, Models and Information
- Synthetic intermediates databases help speed synthesis work
- Contents of top chemical catalogs to find needed chemicals fast
- Literature database to quickly find up-to-date, relevant references
- Full contents of the ChemFinder WebServer
- Structure database from NCI to locate pharmacophores