IRCloggy #metware 2009-06-23

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2009-06-23

sneumann_ joined04:19
sneumann left04:19
egonw joined05:29
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sneumann__ left06:11
sneumann_ morning07:08
egonw morning07:08
sneumann_ moin07:08
zarah saluton sneumann_07:08
egonw BC2 RC3 due today07:08
sneumann_ :-)07:08
egonw almost done with my bug reports07:08
sneumann_ Need more ?07:09
egonw will have Michel Dumontier as guest in our group Thursday07:09
sure, bring them on07:09
sneumann_ only joking :-)07:09
egonw Michel is a OWL guru07:09
involved in bio2rdf on SourceForge07:09
so, will brush up OWL in BC207:09
and part of that07:09
will work in a MetWare plugin for BC207:10
finally07:10
sneumann_ Ah. My questions would be about "inheritance" between our Concepts07:10
egonw right07:10
sneumann_ if we want that, and if so, how to do that07:10
egonw not sure how much he worked with SKOS though07:10
this ArMet design sucks07:10
clearly made by non IT people07:10
sneumann_ Don't let Nigel hear that07:11
egonw at PRI we wanted the compatibility too...07:11
I'm sure the covers the MRS07:11
but07:11
the model is not nice07:11
OWL without SKOS could do much better07:11
MetWare 207:11
sneumann_ Nigel always touted ArMet as a "strawman" to get things started and to talk about07:12
egonw first I need to get myself to finish that bloody paper :(07:12
sneumann_ which measn divergence is not a crime07:12
egonw true07:12
sneumann_ and you can always say "modelled after ArMet Design"07:12
egonw try explain that to your peers behind the MS machines07:12
sneumann_ Hollywood is doing all sorts of nasty things to books07:12
Have the MS people ever submitted something ArMetty anywhere ?07:13
We have two metware issues here07:13
egonw has had way to many political meetings07:13
egonw file them as bug reports please07:13
everything you want me to look at...07:13
with BC2.0.0 about out of the way07:14
I have more time for my own research interests...07:14
sneumann_ Ack07:14
egonw aka MS-based metabolomics07:14
and metabolite identity in particular07:14
sneumann_ have you seen our MetFlow prototype ?07:14
egonw no, but I love a demo07:15
sneumann_ http://msbi.ipb-halle.de/MetFlow/07:15
zarah sneumann_'s link is also http://tinyurl.com/l56utv07:15
sneumann_ the "run workflow" is a bit hard to find, it is a button with screen width ...07:15
it runs quite a while, because it has 3 external web ressources to call07:16
MassBank, PubChem, KEGG07:16
egonw I've hit 'Start workflow'07:17
sneumann_ wait 2 mins07:17
egonw but don't get confirmation it is running07:17
sneumann_ The button is greyed out ?07:17
egonw yes, it is07:17
sneumann_ If not, which browser ?07:17
egonw I confused that for the HTML page bit being selected...07:17
s_wolf joined07:18
sneumann_ We don't (yet) have the Taverna callbacks with progress bar07:18
egonw can you have the button(?) title updated too, to, say, Running Workflow...07:18
?07:18
sneumann_ Just told Michael07:18
egonw OK, got results...07:18
nice!07:19
sneumann_ Especially the KEGG Pathways07:19
with highlights07:19
egonw can I bookmark this publically on delicious?07:19
sneumann_ Um, yes.07:19
Currently Michael is working on07:19
the equivalent Workflow with07:20
egonw really nice!07:20
sneumann_ http://msbi.ipb-halle.de/MetFrag/07:20
zarah sneumann_'s link is also http://tinyurl.com/mlamsj07:20
egonw I never got around to but this fluent in JSF...07:20
I never got around to *beÄ this fluent in JSF...07:20
I never got around to *be* this fluent in JSF...07:20
sneumann_ Michael and Sebastion hacked together the prototypes in 2-3 weeks07:20
egonw s_wolf++07:21
mgerlich++07:21
sneumann_ Currently Michael is working on the equivalent Workflow with MetFrag07:21
egonw link not found07:21
sneumann_ and then the combination of MetFrag + MassBank07:21
egonw but I get the point :)07:21
sneumann_ Ahm, MetFrag is not yet public.07:21
Give me an IP (or Range) and I can open it07:21
egonw good question07:22
egonw is looking up his new IP07:22
egonw btw, this 3G broadband is great07:22
sneumann_ but your IP will be changing on each connect ?07:22
egonw quite OK speed, ~2.3km from tower, receiver indoors, non-directed07:23
dunno07:23
sneumann_ it will.07:23
egonw and receiver is WLAN inside07:23
sneumann_ Do you have dyndns.org ?07:23
egonw it has a battery!07:23
I can take the WLAN along on holiday :)07:23
sneumann_ Your wife will love you for that !07:23
egonw no need for routers at the camping anymore07:23
sneumann_ Your neighbours will queue for that07:24
Do you have dyndns.org ?07:24
egonw they can pay the camping :)07:24
sneumann_ Nice businness ahm, holiday plan !07:24
egonw Your IP Address Is: 91.149.41.22907:24
I let you know if it turns out to be dynamic :)07:25
I'm pretty sure it will change when I log in with this modem from Norway :)07:25
from the camping07:25
not sure about relog in...07:25
or changing transmission tower07:25
mmm...07:25
bye bye ADSL07:26
sneumann_ http://msbi.ipb-halle.de/MetFrag/ should be open for you now07:26
zarah sneumann_'s link is also http://tinyurl.com/mlamsj07:26
sneumann_ If you have a egonslaptop.dyndns.org that will be stable07:27
egonw yes, I might think about that07:27
I think I saw my router software support something like that07:28
MetFrag is interesting...07:29
ESI-backed?07:29
ah, no07:29
sneumann_ CDK backed07:29
egonw this is what came out of our pub talk!07:29
sneumann_ right!07:29
There was a paper by Hill et al07:30
in 2008 who used MassFrontier07:30
to select all PubChem entries with matching07:30
parent mass and subject them to MassFrontier for scoring07:30
egonw nice 'Show Frags' pop up07:30
needs a scrollbar though07:30
sneumann_ unfortunately we don't have the Hill PubChem snapshot07:30
so in 2009 we have ~5 times more potential parent masses to score07:31
egonw what's the DOI?07:31
sneumann_ but if you use relative improvements, we're as good as MassFrontier07:31
egonw I think I missed this paper07:31
sneumann_ s_wolf is at it07:32
MetFrag is available as BioMoby service,07:32
egonw who should I ++ ?07:32
sneumann_ soon we'll have to find out about queueing systems07:32
Sebastian :-)07:33
egonw s_wolf++07:33
s_wolf hi egonw07:33
egonw @karma s_wolf07:33
hi :)07:33
zarah s_wolf has a karma of 207:33
s_wolf doi is: 10.1021/ac800548g07:33
egonw s_wolf: thanx!07:34
sneumann_ Both MassBank and MetFrag are going to support mzAnnotate, or better07:34
serve as Test-Bed ;-)07:34
egonw cool07:35
s_wolf but I just compared to the results in the supporting info because there they didn't add any prior knowledge07:35
egonw http://friendfeed.com/egonw/faf46379/metflow-taverna-workflows-in-web-browser-for07:37
zarah egonw's link is also http://tinyurl.com/lpd85z07:38
egonw maybe I should subscribe to the Analytical Chemistry RSS ToC07:39
but noise/value is so high :(07:39
sneumann_ Any clue how to get an RSS of AnalChem with additional search, such as "Mass Spectrometry" ?07:48
egonw no07:48
yahoo pipes could help here07:48
but that requires to create an account07:48
some Perl script would help too07:49
sneumann_ and different topic:07:49
a while ago I had asked about webmeeting solutions, e.g. for a webinar07:49
http://www.webconferencing-test.com/en/webconference_overview.html07:49
zarah sneumann_'s link is also http://tinyurl.com/adhojy07:49
sneumann_ this is an overview of meeting offers, some of them are free.07:49
egonw last time, we used Skype and desktop sharing07:49
that worked pretty well07:49
'we' -> Chris' and our teams07:50
sneumann_ which desktop sharing ? VNC ?07:51
egonw btw, getting quite addicted to the GMail keyboard shortcuts07:51
damn, that makes reading email fast07:51
mom, checking07:52
good question07:53
what was the name again...07:53
delicious failing for me again :(07:57
I let you know when I remember08:00
sneumann_ RSS feeds filtered:08:05
http://www.terkko.helsinki.fi/feednavigator/08:05
zarah sneumann_'s link is also http://tinyurl.com/c46s4w08:05
egonw ah, nice!08:09
metabolomics: http://www.terkko.helsinki.fi/feednavigator/export.php?my=dae35212908:09
zarah egonw's link is also http://tinyurl.com/kucr2v08:09
sneumann_ MedWorm has some userrss as well:08:15
http://www.medworm.com/rss/userss.php?qu=Metabolomics&ftc=79&title=MedWorm+Query%3A+Metabolomics08:15
zarah sneumann_'s link is also http://tinyurl.com/kt2gqt08:15
sneumann_ were you able to create an RSS in feednavigator for08:16
Selected Journals *plus* keyword searches ?08:16
egonw did not try that08:19
'metabolomics' for all journals seemed sufficient...08:19
so lost interest in that combo08:19
sneumann_ It doesnt work as soon as you select "MyFeed only"08:19
and I don't like (citations) which collects about everything ...08:20
results in duplicates08:20
Sascha arrived08:20
egonw 'metabolomics' seems pretty sparse08:20
CIA-47 metware: sneumann * r946 /ISAimport/trunk/src/main/org/metware/isaimport/IsaToClass.java: Automagically detect file.separator08:26
sneumann_ We're just discussing metware08:29
genotype has been renamed to organism at some stage in the past08:29
egonw ha it?08:30
that would not be entirely correct08:30
there may be multiple genotypes for one organism08:30
unles...08:30
organism is considered an instance of a species...08:30
mom...08:30
sneumann_ Second: growth_environment has no connection to another table within the DB08:31
Same for treatment.08:31
We now have entries in these tables, not linked anywhere08:32
egonw about Organism...08:35
sneumann_ sf.net wikis are dead slow atm08:35
egonw it seems indeed to refer to a instance08:35
yes, observed that for the CDK too :(08:36
sneumann_ if we have an instance of an organism pushed into the MS machine08:37
we should still have a collection of genotypes which are living as seeds08:37
in the drawer, waiting for the growth location ;-)08:38
egonw or growth environment ?08:38
sneumann_ ye08:39
s08:39
egonw those links must be added...08:43
IIRC, growth environment is part of a protocol in the ArMet design08:43
bugger...08:43
I need diagrams08:44
sneumann_ me too08:45
I have the postgres snapshot08:45
http://msbi.ipb-halle.de/~sneumann/metware/postgresschema.pdf08:45
egonw yes, that's in front of me too...08:45
zarah sneumann_'s link is also http://tinyurl.com/m6ugoo08:45
egonw well: http://sourceforge.net/apps/mediawiki/metware/nfs/project/m/me/metware/b/b1/Dbdesigner12.png08:46
that one actually08:46
zarah egonw's link is also http://tinyurl.com/l22af808:46
egonw I hate the 'protocol' blob08:49
does not differentiate between the operations the protocol describes08:49
I also note that the PgSQL does not have a direct link between sample and analysisMaterial08:50
which the DBdesigner has08:50
but the growthEnvironment is equally nasty08:51
the metware:Organism (skos:broader armet:Genotype) is confusing08:51
(next time slap me in the face, when we go along with people insisting on ArMet compatibility)08:52
the metware:Organism (skos:broader armet:Genotype) is confusing ...08:52
it is in the middle of a concept of a species-like thing08:52
and an instance08:52
growthEnvironment is definately on the level of instance08:52
in the earlier DBDesigner, the growthEnvironment would have been linked to AnalysisMaterial08:54
because:08:55
the analysis material was extracted from an organismInstance (or GenotypeInstance) which was grown in GrowthEnvironment08:55
sneumann_ sounds like some reorganisation in the SKOS ...09:14
I'd like to see more "event" which link-in a "protocol" being applied09:15
at a certain time09:15
egonw fully agreed09:15
CIA-47 metware: sneumann * r947 /ISAimport/trunk/src/main/org/metware/isaimport/IsaToClass.java: Clarify some more mappings09:40
sneumann_ just came across one of these MOLGENIS object models:10:13
http://gbicserver1.biol.rug.nl:8080/xgap4exampledatasets/doc/objectmodel.html10:13
zarah sneumann_'s link is also http://tinyurl.com/mym3vb10:13
jerzyo joined10:15
egonw hi jerzyo10:16
jerzyo hi10:17
zarah ni hao jerzyo10:18
jerzyo The meeting you e-mailed on the list was yesterday 16:30 (Halle, CEST) OR today?10:19
sneumann_ please, not another typo in my mail... checking10:19
Tuesday, 16:3010:20
I just sent around the "relocation" to #taverna. Somehow #metware was all over my mind :-(10:20
egonw sneumann_++10:23
jerzyo I am new to IRC10:23
Is this on taverna or on metware10:24
?10:24
sneumann_ no problem. Your IRC client should have "Join channel" somewhere, and just go to "#taverna"10:24
egonw this is the #metware channel10:24
sneumann_ here is #metware10:24
jerzyo And BTW what #metware is about?10:24
egonw see metware.org10:24
metabolomics10:25
sneumann_ metware.org is a collection of projects10:25
aimed at metabolomics databases, services and workflows.10:25
jerzyo It seems you have some RAW data10:26
Is there any access to it?10:26
sneumann_ What kind of are you talking about ?10:26
Xcalibur .RAW files ?10:27
mgerlich eqonw: the start worklflow button now changes to "workflow running" and then switches to "workflow finished"10:30
egonw great!10:32
jerzyo Well, I am searching for text files wiith biological data in many formats10:33
egonw with what goal?10:33
jerzyo Get some training data for students10:35
egonw why text files?10:36
CIA-47 metware: sneumann * r948 /BigMet/trunk/src/main/resources/metware.skos: Added machine setup as field to run10:36
jerzyo because they are easier to handlethan binary files10:49
there are plenty of different formats10:50
egonw yes10:50
what programming language will the students use?10:50
jerzyo and they are much more difficult to handle than XML10:50
Python10:50
sneumann__ joined12:18
egonw sneumann__: ping12:28
first iterating in BC2 would be single database...12:28
does that make sense?12:28
that is, directly on MySQL...12:28
grabbing content from other DBs via RDF is scheduled for later...12:28
sneumann__ left12:55
sneumann_ egonw: pong14:16
egonw :)14:16
yeah, it's a long distance :)14:17
CIA-47 metware: sneumann * r949 /ISAimport/trunk/src/main/org/metware/isaimport/IsaToJava.java: Removed one of the early prototypes14:28
jerzyo Got to go15:26
bye15:26
jerzyo left15:26
egonw is commiting the intial Bioclipse plugin code15:57
egonw took me some time to get the preference page working correctly :(15:57
now setting up a bioclipse manager for Metware16:07
INFO - Bioclipse manager: metware added to Javascript environment16:16
:)16:17
sneumann__ joined17:18
CIA-47 metware: SaschaRichter * r950 /ISAimport/trunk/src/main/org/metware/isaimport/IsaToClass.java: 17:54
metware: "line.separator-problem" solved.17:54
metware: (Had nothing to do with line.separator but with counting lines.)17:54
sneumann__ egonw: still around ?18:16
I'd like to see how to push the SKOS -> SQL DDL generation step.18:16
Either with or without the BioMart support.18:17
Preferrably with.18:17
egonw back18:30
not sure for how long...18:30
starting to feel ill18:30
sneumann__ Question is18:32
whether we try to generate the SQL purely from Concepts18:33
or add some SKOS annotation that helps SQL18:33
egonw as we did so far... (?)18:33
we currently use some annotation18:33
sneumann__ hm, the <metware> tags were the _only_ hint for the SQL18:33
egonw I remember we talked about trying to remove that annotation18:33
sneumann__ exactly18:33
egonw yes, but an important hint18:34
it is currently used to decide what belongs to which table18:34
and what the field names are18:34
which was needed for the biomart compatibility18:34
sneumann__ one idea we had was that every concept below the collection becomes a table18:34
and every concept below the table becomes a field18:34
egonw right18:35
sneumann__ which breaks if we leave that somple scheme18:35
what's missing is a hint18:35
whether we have 1:1 1:n or n:m relations between concepts18:35
every 1:1 can become a field18:35
every 1:n becomes a link18:35
and every n:m needs a "koppeltabelle"18:35
egonw rdf:type sql:Table etc?18:36
sneumann__ that is very explicit.18:36
it talks about SQL tables18:36
egonw yes18:36
sneumann__ and won't help if we want to use the information18:37
also e.g. for the JSF pages or Java Beans18:37
egonw true18:37
mom18:37
check the metware.skos18:37
sneumann__ Cardinality between concepts18:37
egonw i added some OWL axioms18:37
sneumann__ similar to broader18:37
egonw right18:38
we could have a field have a skos:broader to another table...18:38
but the trick would be too see ...18:38
which of the two or more (because Armet is a broader too), is the table pointed too18:39
instead of the table to which the field belongs to itself18:39
we could subclass skos:broader18:39
into metware:propertyOf18:40
and metware:pointsTo18:40
or refersTo18:40
refersToA perhaps18:40
sneumann__ makes sense18:40
this will allow more idioms checking18:41
and is more in line with SKOS thinking18:41
egonw yes18:41
sneumann joined19:01
sneumann__ left19:15
sneumann get better, see you19:57
steffen19:57
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sneumann left20:46
egonw left21:51

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