Could this flowchart applicable for a virtual screening platform for material design?
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RT @rguha: @iwatobipen One could argue that the fingerprints are not designed for VS, but rather for similarity/substructure searches. It'd…
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@iwatobipen One could argue that the fingerprints are not designed for VS, but rather for similarity/substructure searches. It'd be interesting to run them through https://t.co/9GEzVNEoyp
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Highlighting the work of @dr_greg_landrum and Sereina Riniker on fingerprint benchmarking: Open-source platform to benchmark fingerprints for ligand-based virtual screening. https://t.co/ZJ9kAXMFgp #Shef2019