kylelutz / chemkit

A C++ library for molecular modelling, cheminformatics and molecular visualization.
http://www.chemkit.org
BSD 3-Clause "New" or "Revised" License
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Adds improvement for save and save as of files with mol extension #24

Closed tufangorel closed 13 years ago

tufangorel commented 13 years ago

This feature forces the user to save files with mol extension.

kylelutz commented 13 years ago

I don't feel that this is the right way to solve the problem. The code in this patch limits the chemkit-builder application to only save files in the mol file format even though the chemkit library supports many others.

I have added code to fix the bug. See commit SHA: 34055854ffa3bc8b8bc2.