An Efficient Graph Generative Model for Navigating Ultra-Large Combinatorial Synthesis Libraries

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Germany BioSolveITTutorials
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Published on ● Video Link: https://www.youtube.com/watch?v=taZNE9qluuk


Duration: 27:03
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From DrugSpace 2023 "A Network of Possibilities"

Speaker: Henry van den Bedem (Atomwise)

#MachineLearning #MedChem #CompChem #VirtualScreening #AI



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Tags:
docking
molecular modeling
compounds
virtual screening
screening
medicinal chemistry
computational chemistry
FBDD
DD
CADD
covalent
synthesis
organic chemistry
molecular modelling
homology model
homology modelling
protein
target
interactions
ligand