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asciimol's Issues

Possible new feature: the autorotation tool

Hello!

This is a very cool project! Although I'm missing one feature that would be useful: the autorotation tool that would allow for the continuous rotation of a molecule. Is it possible to add it in the future?

rdkit-pypi dependency

asciiMol is a really cool project, but the dependency on rdkit-pypi is quite limiting imho. There are other and arguably better ways to install RDKit, including the conda package manager. In the spirit of a terminal program, I think it would make more sense to have xyz generation from smiles as a separate first step, for example

gen_xyz_from_smiles "CCCC" > butane.xyz
asciimol butane.xyz

Anyway, if you want to keep it, I think the best thing is to make rdkit-pypi an optional dependency. It is anyway imported only within the function read_smiles.

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