Insightful talk by Anthe Janssen at #NWOCHAINS. He talked about his research with Dompé Farmaceutica in the framework of #ChemistryNL on using #docking and #MachineLearning-assisted re-scoring to better predict compound binding affinity to #kinases.
https://pubs.acs.org/doi/10.1021/acs.jcim.4c01260
#Chemistry #ChemBio #DrugDiscovery
CC: @LED3hub