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Binding

Binding drug to protein

Drug: Paste your ligand in SMILES format i.e. for Hydroxychloroquine SMILE format is: Clc1cc2nccc(c2cc1)NC(C)CCCN(CC)CCO

Protein: Paste your protein as a chain sequence i.e. for HIV-protease PQITLWQRPLVTIKIGGQLKEALLDTGADDTVLEEMSLPGRWKPKMIGGIGGFIKVRQYDQILIEICGHKAIGTVLVGPTPVNIIGRNLLTQIGCTLNF

https://mybinder.org/v2/gh/PiotrKarabowicz/binding/master?filepath=Binding.ipynb

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