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The changes made from v.4.4 to 5.0 concern mostly the format
of the input files:
- The main input file is written now in ``keyword - value''
manner, where the order of keywords in almost arbitrary.
- The molecular description files have now extension ``.mmol''.
Most of old .mol files can be just renamed to .mmol
- A few parameters of the old input file (concerning, for example,
treatment of 1-4 neighbors) are now moved into .mmol files.
There are also some changes in functionality, see the description below.
Alexander Lyubartsev
2007-01-02