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This tutorial was written because computational chemistry applied in the right way has
an enormous potential in research.
Due to the lack of helpful introductions and a time consumptive orientation in this issue
the appliance of this technology is less than it could/should be.
Nowadays computer technology is able to calculate chemical behaviour of molecules
used in research with an adequate accuracy in a manageable time.
In am sure that in 5-10 years every bigger research group will have one scientist who will
support current assays.
Computational chemistry has a kind of elitist reputation, because there are several
requirements to use this technology in a serious way.
One need good chemical imagination, good computer knowledge, experience in
preparing calculations, time to do that and of course an appropriate hardware and
software.
I hope this document will help a little bit to enlarge distribution of such technology.
M. Checinski
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