ky66/ROBIN
An analysis of a new experimentally-derived nucleic acid binding chemical library
ROBIN helps scientists in drug discovery evaluate new chemical compounds for their likelihood to bind to RNA rather than proteins. By inputting the 3D structures of small molecules, it outputs a prediction of their RNA-binding potential. This is especially useful for medicinal chemists and pharmacologists working on RNA-targeted therapeutics.
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Use this if you need to quickly assess whether a novel small molecule is likely to interact with RNA, distinguishing it from protein binders.
Not ideal if you need a precise quantification of binding affinity or a detailed mechanism of interaction rather than a classification.
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Language
Jupyter Notebook
License
MIT
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Last pushed
Jan 27, 2023
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