Program

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Wednesday, November 3

8:00 – 5:15 Registration and Exhibits
8:00 – 8:30 Breakfast
8:30 – 8:45 Welcome
Travis Earles (Office of Science & Technology Policy)
Purpose of Workshop
Mark Tuominen (National Nanomanufacturing Network)
8:45 – 10:05 Project Demonstrations
Introduction: Mark Tuominen (National Nanomanufacturing Network)
8:45 – 9:05 caNanoLab
Sharon Gaheen (SAIC)
9:05 – 9:25 nano-TAB
Stacey Harper (Oregon State University)
9:25 – 9:45 Development of a Multi-Criteria Decision Analysis Tool to Support Selection of Nanomaterial Studies
Gretchen Bruce (Intertox, Inc.)
9:45 – 10:05 Web Interfaced Nanotechnology ESOH Guidance System (WINGS) -- An Overview
Aaron Small (Luna Innovations)
10:05 – 10:30 Break
10:30 – 12:00 Opening Keynotes
Introduction: Jeff Morse (National Nanomanufacturing Network)
10:30 – 11:15 nanoHUB.org and the Delivery of Value to Authors and Users
George Adams (Network for Computational Nanotechnology)
11:15 – 12:00 Nanotoxicology as a Predictive Science That Can Be Explored by High Content Screening and the Use of Computer-assisted Hazard Ranking
Andre Nel (University of California, Los Angeles)
12:00 – 1:00 Lunch
1:00 – 2:15 Theme 1 Presentations: Data Collection and Curation
Co-chairs: Stacey Harper, Yoram Cohen, Peter Schad
1:05 - 1:25 Collaboration and Data Management
Yoram Cohen (University of California, Los Angeles)
1:25 - 1:50 Nanoparticle Ontology for Cancer Nanomedicine Research
Nathan Baker (Pacific Northwest National Laboratory)
1:50 - 2:15 The Collaboratory for Structural Nanobiology: Nanoparticle Structural Analysis as a Rosetta Stone
Raul Cachau (SAIC-Frederick)
2:15 – 2:30 Break
2:30 – 3:45 Theme 2 Presentations: Tools for Innovation, Analysis, and Simulation
Co-chairs: Anne Chaka, Mark Tuominen, Michael McLennan
2:35 - 2:55 Nanoparticles Toxicity: Knowledge Extraction from High-Throughput Screening Data
Rong Liu (University of California, Los Angeles)
2:55 - 3:20 Cloud Computing for Science
Kate Keahey (Argonne National Laboratory)
3:20 - 3:45 Scientific Workflow Tools
Daniel Crawl (San Diego Supercomputer Center)
3:45 – 4:00 Break
4:00 – 5:15 Theme 3 Presentations: Data Accessibility and Information
Sharing

Co-chairs: Michele Ostraat, Mark Hoover, Rebecca Reznik-Zellen
4:05 - 4:25 Considerations in the Application of Nanoinformatics to Occupational Safety and Health
Paul Schulte (NIOSH)
4:25 - 4:50 PhenX Measures for Data Sharing, Cross-study Analysis and Data Interoperability
Carol Hamilton (RTI)
4:50 - 5:15 The Implications of Open Notebook Science and Other New Forms of Scientific Communication for Nanoinformatics
(See the Useful Chemistry Blog for more.)
Jean-Claude Bradley (Drexel)
5:15 - 6:00 Break
6:00 – 7:00 Poster Session and Reception
7:00 – 8:00 Keynote Banquet
Introduction: Mark Hoover (NIOSH)
7:30 - 7:40 Remarks from the NanoBusiness Alliance
Vincent Caprio (NanoBusiness Alliance)
7:40 - 8:00 Remarks on the State of Nanotechnology
Mihail C. Roco (National Science Foundation)

Thursday, November 4

8:00 – 5:15 Registration and Exhibits
8:00 – 8:30 Breakfast
8:30 - 10:00 Roadmapping Set Up: Additional Perspectives
Introduction: Vicki Colvin (Rice University)
8:35 - 9:00 EPA Perspectives on Nanoinformatics for Prioritization and Toxicity Testing
Sumit Gangwal (National Center for Computational Toxicology)
9:00 - 9:25 Nanoinformatics in Europe: The ACTION Grid White Paper
Victor Maojo (Universidad Politecnica de Madrid)
9:25 - 9:50 Getting to "The 5 Stars of Linked Open Data" for Nanoinformatics
Mills Davis (Project10x)
10:00 – 10:30 Break
10:30 - 12:00 Roadmapping Set Up: Project Vignettes
Introduction: Phil Lippell
10:35 - 11:35 nanoHUB.org
Michael McLennan (Purdue University)
  CoSMIC
Krishna Rajan (Iowa State University)
  NIST
Anne Chaka (NIST)
  ICON GoodNanoGuide
Vicki Colvin (Rice University)
  Nanoparticle Information Library
Mark Hoover (NIOSH)
  NIOSH Field Teams
Chuck Geraci (NIOSH)
  NNN & InterNano
Jeff Morse (National Nanomanufacturing Network)
  caNano Working Group
Nathan Baker(Pacific Northwest National Laboratory)
  NCL
Marty Fritts (Nanotechnology Characterization Laboratory)
  NBI Knowledgebase
Stacey Harper (Oregon State University)
  Materials Registry
Michele Ostraat (Research Triangle Institute)
11:35 - 12:00 Panel Discussion
Phil Lippell, moderator
12:00 – 1:00 Lunch
1:00 – 2:15 Themed Breakouts
Theme 1: Data Curation and Collection
Theme 2: Tools for Innovation, Analysis, and Simulation
Theme 3: Data Accessibility and Information Sharing
Theme 2 additional presentations Nanoinformatics from the Biomedical Informatics Perspective
G. H. Lopez-Campos (Institute of Health "Carlos III")
  Developing a Virtual Vault for Pseudopotentials:A NNIN/C Initiative
Derek Stewart (Cornell University)
  Using Open-Source Scripting Langauge for Rapid-development of Informatics Capabilities
Craig Versek (University of Massachusetts Amherst)
2:15 - 2:30 Break
2:30 - 3:45 Themed Breakouts
Theme 1: Data Curation and Collection
Theme 2: Tools for Innovation, Analysis, and Simulation
Theme 3: Data Accessibility and Information Sharing
3:45 - 4:00 Break
4:00 - 5:15 Themed Breakouts
Theme 1: Data Curation and Collection
Theme 2: Tools for Innovation, Analysis, and Simulation
Theme 3: Data Accessibility and Information Sharing
5:15 - 6:00 Break
6:00 – 7:00 Reception
7:00 – 8:00 Networking Dinner

Friday, November 5

8:00 – 8:30 Breakfast
8:30 – 10:00 Report In and General Discussion
Introduction: Krishna Rajan (Iowa State University)
8:35 - 10:00 Moderator: Anne Chaka (NIST)
10:00 – 10:30 Break
10:30 – 12:00 Pilot Planning for Nanoinformatics 2011
Introduction: James Luo (National Institutes of Health)
10:30 - 12:00 Moderator: Marty Fritts (NCL)
12:00 – 1:00 Closing Keynote Luncheon
Introduction: Mark Tuominen (National Nanomanufacturing Network)
12:30 - 1:00 Sylvia Spengler (National Science Foundation)