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Data models for digital preservation and
publishing beyond the PDF
Jun Zhao, Mark Thompson, Kristina Hettne,
Stian Soiland, Susana Garcia , Marco Roos
Acknowledging
Harish Dharuri, Susanna Sansone, Philipe Rocca-Sera,
Alejandra Gonzales-Beltran, Albert Mons, Arie Baak, Erik
Schultes, Carole Goble, Barend Mons
The Workflow Forever project (EU FP7 nr. 270192),
Digital Libraries and Digital Preservation. (ICT-2009.4.1)
Recording your computational steps…
Bioinformaticians
have no labbooks!
and no training on
digital notekeeping
http://graemefielder.wordpress.com/2010/09/17/lab-books-evolution-required/
State of the art study capture?
How then?
Workflows encapsulate in silico analysis
http://ap27-cgla.blogspot.nl/ http://openi.nlm.nih.gov/detailedresult.php?img=2743669_1471-2105-10-252-2&req=4
5
Components to understand an experiment
Is a workflow enough?
Workflow:
Which biological
pathways explain the
associations?
Interpret results
(Interaction
pathways in the
cell)
Research Question
Genome Wide Association Studies (GWAS)
In 1000+ people: which gene
mutations are associated
with metabolic syndrome,
and why?
Download data
- External DB
- Existing
Knowledge
Hypothesis
Genes involved in
inflammation pathways are
involved in the onset of
metabolic syndrome.
6
Components to understand an experiment
Is a workflow enough?
Workflow:
Which biological
pathways explain the
associations?
Interpret results
(Interaction
pathways in the
cell)
Research Question
Genome Wide Association Studies (GWAS)
In 1000+ people: which gene
mutations are associated
with metabolic syndrome,
and why?
Download data
- External DB
- Existing
Knowledge
Hypothesis
Genes involved in
inflammation pathways are
involved in the onset of
metabolic syndrome.
Research Object
Data
Method/Experi
mental protocol
Findings
Types of resources
ISA-TAB/ISA2OWL
Nanopublication
ISA-TAB/ISA2OWL
Wfdesc
Data Models
Capture more than workflows
Research Object Model
Preservation for understanding
Preserve at least the:
– Hypothesis
– A workflow-like sketch
– One or more workflows
– Input data
– Workflow runs
– Results
– Conclusion
My Research Book
9
Fame and Glory
It was
me, me,
me!
What I
found
How I
found
it
HDAC1 interacts with Parvb
Discovered by: me
Nanopublication
Assertion
Provenance of Assertion
Metadata of
nanopublication
Prototyping the models
• Create: myExperiment
• Better: Checklist service
• Evolution: Digital Library software
• Curation: Quality Monitoring Service
• Credit original assertions: LandMark Tool
• Applications by private partners
myExperiment
- create Research Objects
Prototyping the Research Object Data Model in
Checklist service
- make better Research Objects
Prototyping the Research Object Data Model in
http://www.wf4ever-project.org/wiki/display/docs/RO+checklist+evaluation+API
http://www.wf4ever-project.org/wiki/display/docs/RO+checklist+evaluation+API
RELEASE!  http://www.wf4ever-project.org/wiki/display/docs/RO+checklist+evaluation+API
Digital Library software
- evolution of a Research Object
Prototyping the Research Object Data Model in
Research Object ‘under construction’
Snaphots to record intermediate states
Full copy ‘Ready for Release’
Quality Monitoring Service
- Long term curation
Prototyping the Research Object Data Model in
Landmark Claim Tool
- mark and credit the first discovery
Prototyping the Nanopublication Model
Landmark Claim Tool
Core data
Attribution
Qualification
Applications from private partners
- Robust tools for business stakeholders
Prototyping the Nanopublication Model
Nanopublication applications
Euretos Company
Copyright Euretos b.v. 2013
48
Releases planned for 2014
Some gory detail
Data models ‘under the hood’
Research Object Model at a glance
50
Research
Object
Resource
Resource
Resource
Annotation
Annotation
Annotation
oa:hasTarget
Resource
Resource
Annotation graph
oa:hasBody
ore:aggregates
Manifest
For more information and extensions (Evolution model, MINIM) see
http://wf4ever-project.org/
Extensions
Wf4Ever architecture
52
Semantic REST API
RDF triple store
(RO structure,
Annotations)
RO index
Uploaded files
PortalChecklist
service
Command
line
Workflow
runner
...
Nanopublication Data Model
Assertion
Nanopublication URL
Provenance PublicationInfo
assertio
n
opm:
was
Derived
From
opm:
wasGene-
ratedBy
this
nanopub
dcterms:
created
pav:
authored-
By
associa-
tion
a
sio:statis-
ticalAssociation
sio:has-
measurem
entValue
Association_1_
p_value
a
Sio:probability-
value
sio:has-value
6.56e-5
^^xsd:float
sio:
refers-to
dcterms:
DOI
…
Integrity Key
An Individual association
between concepts:
• statement or declaration
• measurement
• hypothetical inference
• quantitative or qalitative
Guarantee immutability
after publication
Unique, persistent and
resolvable identifier
How this assertion came
to be, methods,
evidence, context, etc.
• Detailed attribution
for authors,
institutions, lab
technicians, curators
• License info
• Publication date
Assertion
http://www.store.net/mynanopub.rdf
Provenance Publication-
Info
SoapDenovo 2
increases correct
assembly length by
3-80 times over
Soapdenovo 1
pav:authoredBy
dc:rights
dc:created
A Galaxy
workflow
results
slides
hypothesis
Research object can
link to a nanopub as
an experimental
result
ro:aggregates
Assertion
http://www.store.net/mynanopub.rdf
Provenance Publication-
Info
SoapDenovo 2
increases correct
assembly length by
3-80 times over
Soapdenovo 1
pav:authoredBy
dc:rights
dc:created
A Galaxy
workflow
results
slides
hypothesis
Nanopublication
gains detailed
workflow
provenance by
linking to RO
ro:aggregates
rdf:describedBy
Assertion
http://www.store.net/mynanopub.rdf
Provenance Publication-
Info
SoapDenovo 2
increases correct
assembly length by
3-80 times over
Soapdenovo 1
pav:authoredBy
dc:rights
dc:created
A Galaxy
workflow
results
ro:aggregates
slides
hypothesis
Extend your
provenance!
E.g. link the claim to the
original data elements
from which it was derived
rdf:describedBy
Assertion
http://www.store.net/mynanopub.rdf
Provenance Publication-
Info
SoapDenovo 2
increases correct
assembly length by
3-80 times over
Soapdenovo 1
pav:authoredBy
dc:rights
dc:created
A Galaxy
workflow
results
ro:aggregates
slides
hypothesis
?
rdf:describedBy
Community effort
• Research Objects
http://researchobjects.org/
http://wf4ever-project.org/
• Nanopublication
http://Nanopub.org/
• ISA-tools
http://www.isa-tools.org/
• Research Objects Community Group at W3C
http://w3.org/community/rosc
W3C community group for RO
http://www.w3.org/community/rosc/
Conclusions (1/2)
• Applications of RO and Nanopublication data
models to capture the bioinformatics research
process ‘beyond the PDF’
• Data models:
ISA, Research Objects, Nanopublications
Conclusions (2/2)
• Reference implementations / first to adopt:
myExperiment, DLibra, Checklist service,
Curation/monitoring, Landmark tool
• Private partners developing stable
nanopublication applications
• Prevent perfectionism of the developers:
get involved now!
THANK YOU FOR YOUR ATTENTION
http://researchobject.org/ http://nanopub.org/ http://isa-tools.org/
Research Object Community group at W3C: http://w3.org/community/rosc

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Data models for preserving and publishing digital research material beyond the PDF

Notes de l'éditeur

  1. Attribution is part of the RO model and myExperiment, but we are also developing something specifically to address this aspect of digital preservation and publishing… Nanopublications
  2. http://www.wf4ever-project.org/wiki/display/docs/RO+checklist+evaluation+API
  3. http://www.wf4ever-project.org/wiki/display/docs/RO+checklist+evaluation+API
  4. http://www.wf4ever-project.org/wiki/display/docs/RO+checklist+evaluation+API
  5. expected (based on previous knowledge) or serendipitous result/finding?
  6. So let’s have a look at what a Research Object looks like. The core is the concept of the Research Object itself, which you may also known as an ORE aggregation. This is described by the manifest, which is simply an RDF file. The RO aggregates a series of resources – in Linked Data these could be anywhere in the world. Additionally it aggregates a set of annotations, which we know is the link between a target resource (here aggregated in the RO), and an body resource. In Wf4Ever we typically provide the body as a separate RDF Graph, so that we can use existing vocabularies to describe and relate the resources.
  7. new schemalandmark screenshotworkflow hypothese sketch
  8. new schemalandmark screenshotworkflow hypothese sketch
  9. new schemalandmark screenshotworkflow hypothese sketch
  10. new schemalandmark screenshotworkflow hypothese sketch
  11. So we have recently formed a W3C Community Group for Research Object, which has gathered significant interest, 75 participant. As you see, I am one of the chairs, and so is Rob which you already know from OA group. We are just starting up, and our focus in the RO community group is rather how to practically use Research Objects as a concept than to specify a new model – we’ll refer to existing models where it’s appropriate, but also explore other models which could be described as research objects.