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Cheminformatics Resources of U.S. Governmental Organizations Workshop · 2027
Cheminformatics Resources of U.S. Governmental Organizations 2027 Workshop
Apr 12–14, 2027
FDA White Oak Campus · Calverton, MD · In person and online
A three-day workshop hosted by FDA's Modeling and Simulation Working Group and Chemical Informatics and Modeling Interest Group to improve communication and collaboration among U.S. government-funded organizations that build chemical databases, standards, datasets, methods, and computational resources. Sessions cover cheminformatics for analytical chemistry, new approach methodologies, and AI/ML for drug repurposing and discovery. Registration is limited to government employees and contractors; attendance is in person at White Oak or by webcast.
- Venue
- FDA White Oak Campus
- Program
- 3 sessions
- 7 speakers
- Organizer
- U.S. Food and Drug Administration (FDA)
Agenda
Sessions
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Application of Cheminformatics to Support Analytical Chemistry
Tytus Mak, NIST, Mass Spectrometry Data Center Karen E. Butler, FDA, Human Foods Program
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Cheminformatics for New Approach Methodologies (NAMs)
Huixiao Hong, FDA, National Center for Toxicological Research Evan Bolton, NIH, National Center for Biotechnology Information
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AI/ML for Drug Repurposing and Drug Discovery
Ewy Mathé, NIH, National Center for Advancing Translational Sciences Samir Lababidi, FDA, Office of the Commissioner, OMITS Alexey Zakharov, NIH, National Center for Advancing Translational Sciences
Speakers
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NIST, Mass Spectrometry Data Center
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FDA, Human Foods Program
-
FDA, National Center for Toxicological Research
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NIH, National Center for Biotechnology Information
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NIH, National Center for Advancing Translational Sciences
-
FDA, Office of the Commissioner, OMITS
-
NIH, National Center for Advancing Translational Sciences
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