Semichem, Inc. — Providers of Solutions for Computational Chemistry
Quantitative Structure/Activity Relationships (QSAR)
- Automatically computes over 500 descriptors (topological, geometric, constitutional, thermodynamic, electrostatic, quantum mechanical)
- Advanced statistical analysis (5 regression analyses, heuristic, 4 multivariate analyses)
- GUI for file and information management
- Full integration with AMPAC 8
- Full integration with Gaussian 98/03
- Extensive manual with tutorials
- PREDICT module automates the use of AMPAC and CODESSA
