Notices tagged with chembl
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about 2 months ago from web
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nice overview of #chembl #rdf resources in the #biohack2011 wiki → http://bit.ly/pgY19V (~4/5th of page)
about 6 months ago from Choqok -
about 6 months ago from Choqok
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while #virtosos is loading the #chembl #rdf, the #cdk has a hack session, just to make sure the new releases hit the web before the #rapture
about 9 months ago from Choqok -
reloading the #chembl #rdf after the graph rename mistake yesterday... almost 1.5GB of triples ... total loading time 45 mins :)
about 9 months ago from Choqok -
argh... getting all the new #chembl 09 #rdf into #virtuoso is keeping me busy... escaping backslashes, removing newlines ... :(
about 9 months ago from Choqok -
cool. #chembl data loaded with many InChIs... not all, only InChIs of less then 512 chars... dunno the exact #virtuoso URI length limit yet
about 9 months ago from Choqok -
just learned that ACD predicted pKa values are part of CC-BY-SA #ChEMBL... good for benchmarking!
about a year ago from Choqok -
about a year ago from Choqok
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#chembl database data as a wiki -> http://goo.gl/BJBW #rdf #mediawiki
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attending the #ukqsar2010 meeting... listening to Anne Hersey about #ChEMBL -> http://www.ebi.ac.uk/chembldb (you should know that by now :)
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watching a really great #rdf #chembl #drugbank viz demo of http://triplemap.com/ (using #cdk too :)
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#chembl blogpost on #bioclipse and substructure mining with #moss has gone live: http://ur1.ca/0z3xb
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and I learned that #chembl has ~390k assays with one associated target, and some 800 with more than 10 targets... http://2tu.us/1rfd
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for example, now I know there are 3 targets on distinct assays in #chembl with more than 500 molecules tested against it
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not really enjoyed #chembl today... too late I realized that for some assays one does not know the target, so multiple targets can be given
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