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FAIRer Research
Professor Carole Goble CBE FREng FBCS
The University of Manchester, UK
carole.goble@manchester.ac.uk
STM Conference, London, 3rd Dec 2014
“An article about computational
science in a scientific publication
is not the scholarship itself, it is
merely advertising of the
scholarship. The actual
scholarship is the complete
software development
environment, [the complete
data] and the complete set of
instructions which generated the
figures.”
David Donoho, “Wavelab and Reproducible
Research,” 1995
datasets
data collections
standard operating
procedures
software
algorithms
configurations
tools and apps
codes
workflows
scripts
code libraries
services,
system software
infrastructure,
compilers
hardware
Systems Biology
Systems Biology
Modelling
Cycle
45 organisations 112 organisations 37 organisations
http://www.seek4science.org
Aggregated Commons
share and interlinking methods, models, data, samples…
multi-stewardship, multi-disciplinary, mixed
Standards
DCAT
FOAF
Data
Models Articles
External
Databases
Metadata
Yellow
Pages
Investigations
Assays
Studies
Towards Interoperable Bioscience Data, Nature Genetics, 2012
Standards, Structure, Interlink
Just Enough Results Model
for things produced and used
in experiments
http://www.fair-dom.org
Findable, Accessible,
Interoperable, Reusable
Data,
SOPs,
Models, Methods
Multi-tenant Commons
Platform
http://datafairport.org
Data discovery
Data assembly,
cleaning, and
refinement
Modeling
Statistical analysis
Data collection
Insights Scholarly Communication
& Reporting
Material & Methods
BioSTIF
instruments and laboratory
Data discovery
Data assembly,
cleaning, and
refinement
Modeling
Statistical analysis
Data collection
Insights Scholarly Communication
& Reporting
Material & Methods
Workflow
Commons
"Mapping present and future predicted distribution patterns for a meso-grazer
guild in the Baltic Sea" by Sonja Leidenberger et al
• 35 kinds of annotations
• 5 Main Workflows
• 14 Nested Workflows
• 11 Configuration files
• 25 Scripts
• 10 Software dependencies
• 1 Workflow management
system
• 1 Web Service
• Dataset: 90 galaxies observed
in 3 bands
José Enrique Ruiz (IAA-CSIC)
Galaxy
Luminosity
Profiling
Dependencies
Components
Rinse and Repeat Research
• Sweep Datasets
• Sweep Variables
• Sweep Steps
SHARING SENSITIVITY
SENSITIVE SHARING
IMPLICATIONS FOR METRICS
BEING FAIR
scientific ego-system for open science
trust, reciprocity, competition
fame
competitive
advantage
productivity
credit
adoption
kudos
for love
blame
scooped
uncredited
misinterpretation
scrutiny
shame
insecurity
cost/time/skills
distraction
responsibility
disruption
staff churn
inertia
Howard Ratner, STM Innovations Seminar 2012
was: Chair STM Future Labs Committee, CEO EVP Nature Publishing Group,
now: Director of Development for CHORUS (Clearinghouse for the Open Research of US)
http://www.youtube.com/watch?v=p-W4iLjLTrQ&list=PLC44A300051D052E5
http://www.myexperiment.org/packs/196.html
http://www.researchobject.org/
Outputs are first class
citizens to be managed,
credited and tracked:
data, software
A Framework to Bundle and Relate multi-hosted
(digital) resources of a scientific experiment or
investigation using standard mechanisms & uniform
access protocols. Carriers of Research Context
Research Objects
What is the RO Framework?
• A framework of models and
conventions
• Representations
• API specifications
• Implementations mapped into
legacy / commodity platforms
KnowledgeTurns
Unit of Scholarly Currency, RO Commons
Circulate in the Scholarly Ecosystem
Citation? Credit? Link to Publishers?
Goble, De Roure, Bechhofer, Accelerating Knowledge Turns, I3CK, 2013
Goble, De Roure, Bechhofer, Accelerating Knowledge Turns, I3CK, 2013
Collaboration to support safe use of
patient and research data for medical
research
Farr Commons
Research Object packages codes, study,
and metadata to exchange coded
descriptions of clinical study cohorts
KnowledgeTurns
Unit of Scholarly Currency, RO Commons
Circulate in the Scholarly Ecosystem
Citation? Credit? Link to Publishers?
arch, Discover, Index, Harvest, Port
Schopf, Treating Data Like Software: A Case for Production Quality Data, JCDL 2012Goble, De Roure, Bechhofer, Accelerating Knowledge Turns, I3CK, 2013
Profile Focus
Body of knowledge around methods, workflows,
software, data, person, rather than publication.
Citation, credit
Release Research
Evolution, Emergence, Discourse, Threaded
Comparison, Historical review, Anti-Salami
Forks, Merges, Fixivity, Citation? Credit?
Flow across groups, projects and articles
Schopf, Treating Data Like Software: A Case for Production Quality Data, JCDL 2012
Reproduce Research
Repeat, Replicate, Recompute, Reuse….
Entropy, Citation? Credit?
icanhascheezburger.com
Zhao, et al .Why workflows break - Understanding and combating
decay inTaverna workflows, 8th Intl Conf e-Science 2012
Can I repeat &
defend my
results?
Can I review, reproduce
and compare my
results/method with your
results/method?
Can I review,
replicate and certify
your results?
Can I transfer your
results into my
research and reuse
this method?
Hettne et al Structuring research methods and data with the research object model: genomics
workflows as a case study 2014 http://www.jbiomedsem.com/content/pdf/2041-1480-5-41.pdf
Reproduce
Repeat, Replicate, Recompute, Reuse….
Entropy, Citation? Credit?
icanhascheezburger.com
Checklists aka Minimum Information Models, Reporting Guidelines
Minim Checklist Ontology, http://purl.org/net/mim/ns
Zhao et. al. A Checklist-Based Approach for QualityAssessment of Scientific Information 3rd In.Workshop on Linked Science, 2013
Hettne et al Structuring research methods and data with the research object model: genomics
workflows as a case study 2014 http://www.jbiomedsem.com/content/pdf/2041-1480-5-41.pdf
Checklists
Versioning
Provenance
Dependencies
Progressive
Metadata
Profiles
Depth: how deeply
described
Coverage: how
much is covered.
More specialised
detail, fewer
services
More
Stakeholders & Services
Citation minimum
Library
Publishers
Experiments
Science
PROV
PAV
VoID GIT
PAV
NISO-JATS
Docker
DC
EXPO, ISA,
JERM, OBI
MIAME, SBML,
SED-ML
wfdesc
MIM Ontology
wfprov
VIVO-ISF
PID
Standards
Machine-processable
Technology Independent
Multi-platform
Incremental
W3C
OADM
DOIs
URIs
Handles
ORCID
OAI-
ORE
RRIDs
host
service
Open Source/Store
Sci as a Service
Integrative fws
Virtual Machines
Portable Packaging
ReproZip
Workflows,makefiles
ProvStore
OMEX archive
bundle
Nanopub: represents structured
data along with its provenance in a
single publishable and citable entry
Galaxy workflows: re-enact the analysis
Research Object:
aggregates the
(digital) resources
contributing to
findings of
(computational)
research (results,
data and software)
as citable
compound digital
objects
http://isa-tools.github.io/soapdenovo2/
http://sandbox.wf4ever-project.org/portal/ro?ro=http://sandbox.wf4ever-project.org/rodl/ROs/SOAP2denovo2-Aureus/
[Alejandra Gonzalez-Beltran
Philippe Rocca-Serra]
• Id & Cite fluid
things
• Uniform handling
1st class citizens
• Compound,
multi-authored
• Mixed, leaky
containers
• Span outcomes,
evolve outputs,
emergence
• Profiles
• Bridge
researchers,
platforms,
resources
Bechhofer,Why linked data is not enough for scientists, DOI: 10.1016/j.future.2011.08.004
[Norman Morrison]
Focus on
Personal
Productivity
not Public Good
Auto-magical
Stealthy not Sneaky
reduce the friction
instrumentation
Training Time
From made RO to born RO
• Open research is like Open software
• Multi-part, multi-contributor, updating
• Tardis & Commons
• Implications for metrics? publishing?
• Learning from open software development
http://www.force11.org
• Barend Mons
• Sean Bechhofer
• Philip Bourne
• Matthew Gamble
• Raul Palma
• Jun Zhao
• Alan Williams
• Stian Soiland-Reyes
• Paul Groth
• Tim Clark
• Juliana Freire
• Alejandra Gonzalez-Beltran
• Philippe Rocca-Serra
• Ian Cottam
• Susanna Sansone
• James Howison
• James Herbsleb
• Kristian Garza
All the members of the Wf4Ever team
iSOCO: Intelligent Software Components S.A.,
Spain
University of Manchester, School of Computer
Science, Manchester, United Kingdom
University of Oxford, Department of Zoology,
Oxford, UK
Poznan Supercomputing and Networking
Center. Poznan, Poland
IAA: Instituto de Astrofísica de Andalucía,
Granada, Spain
Leiden University Medical Centre, Centre for
Human and Clinical Genetics, The Netherlands
Colleagues in Manchester’s Information
Management Group
RO Advisory Board Members
http://www.researchobject.org
http://www.wf4ever-project.org
http://www.fair-dom.org
http://www.datafairport.org

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FAIRer Research

  • 1. FAIRer Research Professor Carole Goble CBE FREng FBCS The University of Manchester, UK carole.goble@manchester.ac.uk STM Conference, London, 3rd Dec 2014
  • 2. “An article about computational science in a scientific publication is not the scholarship itself, it is merely advertising of the scholarship. The actual scholarship is the complete software development environment, [the complete data] and the complete set of instructions which generated the figures.” David Donoho, “Wavelab and Reproducible Research,” 1995 datasets data collections standard operating procedures software algorithms configurations tools and apps codes workflows scripts code libraries services, system software infrastructure, compilers hardware
  • 4. Systems Biology Modelling Cycle 45 organisations 112 organisations 37 organisations
  • 5. http://www.seek4science.org Aggregated Commons share and interlinking methods, models, data, samples… multi-stewardship, multi-disciplinary, mixed Standards DCAT FOAF Data Models Articles External Databases Metadata Yellow Pages
  • 6. Investigations Assays Studies Towards Interoperable Bioscience Data, Nature Genetics, 2012 Standards, Structure, Interlink Just Enough Results Model for things produced and used in experiments
  • 7. http://www.fair-dom.org Findable, Accessible, Interoperable, Reusable Data, SOPs, Models, Methods Multi-tenant Commons Platform http://datafairport.org
  • 8. Data discovery Data assembly, cleaning, and refinement Modeling Statistical analysis Data collection Insights Scholarly Communication & Reporting Material & Methods
  • 9. BioSTIF instruments and laboratory Data discovery Data assembly, cleaning, and refinement Modeling Statistical analysis Data collection Insights Scholarly Communication & Reporting Material & Methods
  • 11. "Mapping present and future predicted distribution patterns for a meso-grazer guild in the Baltic Sea" by Sonja Leidenberger et al
  • 12. • 35 kinds of annotations • 5 Main Workflows • 14 Nested Workflows • 11 Configuration files • 25 Scripts • 10 Software dependencies • 1 Workflow management system • 1 Web Service • Dataset: 90 galaxies observed in 3 bands José Enrique Ruiz (IAA-CSIC) Galaxy Luminosity Profiling Dependencies Components
  • 13. Rinse and Repeat Research • Sweep Datasets • Sweep Variables • Sweep Steps
  • 15. scientific ego-system for open science trust, reciprocity, competition fame competitive advantage productivity credit adoption kudos for love blame scooped uncredited misinterpretation scrutiny shame insecurity cost/time/skills distraction responsibility disruption staff churn inertia
  • 16. Howard Ratner, STM Innovations Seminar 2012 was: Chair STM Future Labs Committee, CEO EVP Nature Publishing Group, now: Director of Development for CHORUS (Clearinghouse for the Open Research of US) http://www.youtube.com/watch?v=p-W4iLjLTrQ&list=PLC44A300051D052E5 http://www.myexperiment.org/packs/196.html
  • 17. http://www.researchobject.org/ Outputs are first class citizens to be managed, credited and tracked: data, software A Framework to Bundle and Relate multi-hosted (digital) resources of a scientific experiment or investigation using standard mechanisms & uniform access protocols. Carriers of Research Context Research Objects
  • 18. What is the RO Framework? • A framework of models and conventions • Representations • API specifications • Implementations mapped into legacy / commodity platforms
  • 19. KnowledgeTurns Unit of Scholarly Currency, RO Commons Circulate in the Scholarly Ecosystem Citation? Credit? Link to Publishers? Goble, De Roure, Bechhofer, Accelerating Knowledge Turns, I3CK, 2013
  • 20. Goble, De Roure, Bechhofer, Accelerating Knowledge Turns, I3CK, 2013 Collaboration to support safe use of patient and research data for medical research Farr Commons Research Object packages codes, study, and metadata to exchange coded descriptions of clinical study cohorts KnowledgeTurns Unit of Scholarly Currency, RO Commons Circulate in the Scholarly Ecosystem Citation? Credit? Link to Publishers? arch, Discover, Index, Harvest, Port
  • 21. Schopf, Treating Data Like Software: A Case for Production Quality Data, JCDL 2012Goble, De Roure, Bechhofer, Accelerating Knowledge Turns, I3CK, 2013 Profile Focus Body of knowledge around methods, workflows, software, data, person, rather than publication. Citation, credit
  • 22. Release Research Evolution, Emergence, Discourse, Threaded Comparison, Historical review, Anti-Salami Forks, Merges, Fixivity, Citation? Credit? Flow across groups, projects and articles Schopf, Treating Data Like Software: A Case for Production Quality Data, JCDL 2012
  • 23. Reproduce Research Repeat, Replicate, Recompute, Reuse…. Entropy, Citation? Credit? icanhascheezburger.com Zhao, et al .Why workflows break - Understanding and combating decay inTaverna workflows, 8th Intl Conf e-Science 2012 Can I repeat & defend my results? Can I review, reproduce and compare my results/method with your results/method? Can I review, replicate and certify your results? Can I transfer your results into my research and reuse this method? Hettne et al Structuring research methods and data with the research object model: genomics workflows as a case study 2014 http://www.jbiomedsem.com/content/pdf/2041-1480-5-41.pdf
  • 24. Reproduce Repeat, Replicate, Recompute, Reuse…. Entropy, Citation? Credit? icanhascheezburger.com
  • 25.
  • 26. Checklists aka Minimum Information Models, Reporting Guidelines Minim Checklist Ontology, http://purl.org/net/mim/ns Zhao et. al. A Checklist-Based Approach for QualityAssessment of Scientific Information 3rd In.Workshop on Linked Science, 2013 Hettne et al Structuring research methods and data with the research object model: genomics workflows as a case study 2014 http://www.jbiomedsem.com/content/pdf/2041-1480-5-41.pdf
  • 27. Checklists Versioning Provenance Dependencies Progressive Metadata Profiles Depth: how deeply described Coverage: how much is covered. More specialised detail, fewer services More Stakeholders & Services Citation minimum Library Publishers Experiments Science PROV PAV VoID GIT PAV NISO-JATS Docker DC EXPO, ISA, JERM, OBI MIAME, SBML, SED-ML wfdesc MIM Ontology wfprov VIVO-ISF PID
  • 30. host service Open Source/Store Sci as a Service Integrative fws Virtual Machines Portable Packaging ReproZip Workflows,makefiles ProvStore
  • 32.
  • 33. Nanopub: represents structured data along with its provenance in a single publishable and citable entry Galaxy workflows: re-enact the analysis Research Object: aggregates the (digital) resources contributing to findings of (computational) research (results, data and software) as citable compound digital objects http://isa-tools.github.io/soapdenovo2/ http://sandbox.wf4ever-project.org/portal/ro?ro=http://sandbox.wf4ever-project.org/rodl/ROs/SOAP2denovo2-Aureus/ [Alejandra Gonzalez-Beltran Philippe Rocca-Serra]
  • 34. • Id & Cite fluid things • Uniform handling 1st class citizens • Compound, multi-authored • Mixed, leaky containers • Span outcomes, evolve outputs, emergence • Profiles • Bridge researchers, platforms, resources Bechhofer,Why linked data is not enough for scientists, DOI: 10.1016/j.future.2011.08.004
  • 36. Focus on Personal Productivity not Public Good Auto-magical Stealthy not Sneaky reduce the friction instrumentation Training Time
  • 37. From made RO to born RO
  • 38. • Open research is like Open software • Multi-part, multi-contributor, updating • Tardis & Commons • Implications for metrics? publishing? • Learning from open software development
  • 40. • Barend Mons • Sean Bechhofer • Philip Bourne • Matthew Gamble • Raul Palma • Jun Zhao • Alan Williams • Stian Soiland-Reyes • Paul Groth • Tim Clark • Juliana Freire • Alejandra Gonzalez-Beltran • Philippe Rocca-Serra • Ian Cottam • Susanna Sansone • James Howison • James Herbsleb • Kristian Garza All the members of the Wf4Ever team iSOCO: Intelligent Software Components S.A., Spain University of Manchester, School of Computer Science, Manchester, United Kingdom University of Oxford, Department of Zoology, Oxford, UK Poznan Supercomputing and Networking Center. Poznan, Poland IAA: Instituto de Astrofísica de Andalucía, Granada, Spain Leiden University Medical Centre, Centre for Human and Clinical Genetics, The Netherlands Colleagues in Manchester’s Information Management Group RO Advisory Board Members http://www.researchobject.org http://www.wf4ever-project.org http://www.fair-dom.org http://www.datafairport.org