The Scope of Computational Chemistry
Basic molecular modelling
Empirical and semi-empirical molecular orbital theory
Basic Quantitative Structure Activity Relationships (QSAR)
Basic ab initio quantum chemistry
Molecular mechanics and dynamics
Advanced molecular modelling
Advanced ab initio quantum chemistry
From 1995 until 2006, these were used for a Master's Degree and Graduate Diploma in Computational Chemistry offered by the Northern Territory University (now Charles Darwin University), Swinburne University of Technology, and Monash University, with help from the University of Tasmania.
General Information on these modules.
As an alternative to our interfaces to Mopac, Gaussian and Gamess and for a
new interface to Tinker,
try the WebMO interface.
Please look at the current status regarding access to these courses.
These pages were written by Graeme Cross; for more information contact Brian Salter-Duke
Last Updated on: 25 May, 2011