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Tag Archives: ChEMBL

Open Drug Discovery Presentation Session with JC Bradley

I had the pleasure of co-presenting with my friend Jean-Claude Bradley today at the “3rd Annual Drug Discovery Partnership: Filling the Pipeline“. Jean-Claude gave a great talk, available on Slideshare here, and discussed the issue of data quality, how improve data gives improved models, the cross-validation of data and proliferation of errors. My talk is on Slideshare here and embedded below. In many ways I discussed similar issues, though not focused on melting point data but rather on structures, structure-identifier relationships, the cross-linking of multiple resources on the internet and how online resources can support Open Drug Discovery Systems. In this presentation I discussed some of the work we are doing on Open PHACTS.

 

 

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Presentation at European Bioinformatics Institute

Last week was quite the trip to the United Kingdom…hit by the flu that put me into bed without a voice for an entire day and then gave the rescheduled talk the next day feeling a little beaten up. The talk discussed the recently conducted survey of public domain databases that I initiated last week (results embedded in the talk) as well as some of the observations comparing data for 10 drugs across a series of Public Domain databases. The meeting was a good chance to meet some of the hosts of some of the databases including PubChem, DrugBank, ChEBI/ChEMBL and SureChem. I’m sorry I missed the first day…

 
 

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