| Name of the Session | CAChe | Spartan | Chem3D | Hyperchem | PC Model | GaussView/ Gaussian |
WebMO | Spreadsheet | |||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| 1. Introduction To Computational Chemistry | Link | Link | Link | Link | Link | Link | Link | ||||||
| 2. Basis Sets | Link | ||||||||||||
| 3. Choice of Theoretical Method | Link | Link | Link | Link | Link | Link | Link | ||||||
| 4. Single Point Energies | Link | Link | Link | Link | Link | Link | Link | ||||||
| 5. Electron Densities and Electrostatic Potentials | Link | Link | Link | Link | Link | Link | |||||||
| 6. Modeling in Solution | Link | Link | Link | Link | Link | Link | |||||||
| 7. Computing Spectroscopic and Thermochemical Properties | Link | Link | Link | Link | Link | Link | Link | ||||||
| 8. QSAR / QSPR | Link | Link | Link | Link | |||||||||
| 9. Transition States | Link | Link | Link | Link | Link | Link | Link | ||||||
| 11. Biochemical Applications of Computational Chemistry | Link | ||||||||||||
| 10. Computational Study of System Dynamics | Spreadsheet | STELLA | Berkeley-Madonna | VenSim PLE | MathCad | ||||||||
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