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Journal Articles
- 2023
[j3]Martin Stroet
, Bertrand Caron, Martin S. Engler, Jimi van der Woning, Aude Kauffmann, Marc van Dijk, Mohammed El-Kebir, Koen Visscher, Josef Holownia, Callum Macfarlane, Brian J. Bennion, Svetlana Gelpi-Dominguez, Felice C. Lightstone, Tijs van der Storm, Daan P. Geerke, Alan E. Mark, Gunnar W. Klau:
OFraMP: a fragment-based tool to facilitate the parametrization of large molecules. J. Comput. Aided Mol. Des. 37(8): 357-371 (2023)- [j2]Martin Stroet, Stephen Sanderson, Audrey V. Sanzogni, Sharif Nada, Thomas Lee, Bertrand Caron, Alan E. Mark, Paul L. Burn:
PyThinFilm: Automated Molecular Dynamics Simulation Protocols for the Generation of Thin Film Morphologies. J. Chem. Inf. Model. 63(1): 2-8 (2023) - 2019
- [j1]Martin S. Engler, Bertrand Caron, Lourens E. Veen, Daan P. Geerke, Alan E. Mark, Gunnar W. Klau:
Automated partial atomic charge assignment for drug-like molecules: a fast knapsack approach. Algorithms Mol. Biol. 14(1): 1:1-1:10 (2019)
Conference and Workshop Papers
- 2018
- [c8]Bertrand Caron, Jordan de la Houssaye, Thomas Ledoux, Sébastien Peyrard, Stéphane Reecht, Jean-Philippe Tramoni:
ARK is in the Air: ARKs Trending in the French-speaking Area and the BnF’s Role in the ARK Story. iPRES 2018 - [c7]Bertrand Caron, Angela Di Iorio, Charles Blair, Lina Bountouri, Rebecca Guenther, Evelyn McLellan, Elizabeth Russey Roke, Esmé Cowles:
PREMIS 3 OWL Ontology: Engaging sets of linked data. iPRES 2018 - [c6]Martin S. Engler, Bertrand Caron, Lourens E. Veen, Daan P. Geerke, Alan E. Mark, Gunnar W. Klau:
Multiple-Choice Knapsack for Assigning Partial Atomic Charges in Drug-Like Molecules. WABI 2018: 16:1-16:13 - 2017
- [c5]Bertrand Caron, Jordan de la Houssaye, Thomas Ledoux, Stéphane Reecht:
Life and Death of an Information Package: Implementing the Lifecycle in a Multi-Purpose Preservation System. iPRES 2017 - [c4]Katherine Thornton, Euan Cochrane, Thomas Ledoux, Bertrand Caron, Carl Wilson:
Modeling the Domain of Digital Preservation in Wikidata. iPRES 2017 - 2016
- [c3]Angela Di Iorio, Bertrand Caron:
PREMIS 3.0 Ontology. iPRES 2016 - 2015
- [c2]Bertrand Caron, Thomas Ledoux, Stéphane Reecht, Jean-Philippe Tramoni:
Experiment, Document & Decide: a Collaborative Approach to Preservation Planning at the BnF. iPRES 2015 - [c1]Bertrand Caron, Andreas Nef, Nancy Hoebelheinrich, Thomas Habing:
Testing the Proposed METS 2.0 Data Model against Use Cases and Complementary Data Models: Presentations and Community Discussion. iPRES 2015
Coauthor Index
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