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Smiles generation of gromos ff tops and conformation generation with rdkit from gromos names |
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Slider for trajectory visualization as an option instead of a looping movie |
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I think this will be part of the #202 |
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Release 3 Ideas
Do you have more feature request for release 3?
Current Features
Plant Features
Ideas and contribution
All ideas and contributions are welcome. Here is the room to discuss it with other people and check for general needs. Of course we can also discuss the plant features.
If you add ideas please specify if you intend to code your idea yourself and what you would need to change.
If you find ideas you like please upvote.
Happy Coding 💻😄 and fruitful discussion
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