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3D-e-Chem / knime-silicos-it

KNIME nodes and example workflows for software made by Silicos-it, ie. align-it, shape-it
Apache License 2.0
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Bundle silicos-it binaries #4

Closed sverhoeven closed 6 years ago

sverhoeven commented 6 years ago

We need binaries for

Each platform should have it's own plugin which is installed only when platform matches.

The silicos-it software depends on openbabel 2.0, so make either static binaries or add openbabel.so/dll to platform plugin.

The LICENSE of this repo should switch to GNU LGPLv3, due distribution of binaries.

The qed meta node is out of scope as it is a Python library, which can not be bundled as it needs RDKit.

sverhoeven commented 6 years ago

It should be possible to use either the bundled binaries or bring your own binaries. This could be implemented by checkbox and file picker on a preference page.

sverhoeven commented 6 years ago

The plugins org.knime.ext.chem.openbabel.bin.win32 ship with a openbabel 2.3.1 datadir and ddl. The linux plugin ships without *.so, but with datadir.

See if we can re-use those.