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Jean-Philip Piquemal

CV of Jean-Philip Piquemal
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Documents
Current affiliations
  • 413221
  • 454935
Researcher identifiers
  • IdHAL jean-philip-piquemal
  • ResearcherId : B-9901-2009
  • ORCID 0000-0001-6615-9426
  • Google Scholar : https://scholar.google.fr/citations?user=z0cOrb0AAAAJ&hl=fr
  • IdRef : 089289439
  • ResearcherId : http://www.researcherid.com/rid/B-9901-2009
Contact
Web site
  • https://piquemalresearch.com/
  • https://mastodon-pa.sorbonne-universite.fr/@piquemal

Presentation

**Jean-Philip Piquemal** Sorbonne Université (SU), Laboratoire de Chimie Théorique, UMR 7616 CNRS, Tour 12-13, 4 place Jussieu, 75252 Paris Cedex, France. Tel:(+33) 144272504 ; FAX: (+33)144274117 ; E-mail : jean-philip.piquemal (at) sorbonne-universite.fr ; Homepage: http://piquemalresearch.com; Twitter: [@jppiquem](https://twitter.com/jppiquem) (personal); [@piquemalgroup](https://twitter.com/PiquemalGroup) (research team) Mastodon: [@piquemal@mastodon-pa.sorbonne-universite.fr](https://mastodon-pa.sorbonne-universite.fr/@piquemal) LinkedIn: [@jppiquem](https://www.linkedin.com/in/jppiquem/) **Research Interests:** * Computational Quantum Chemistry; * Molecular Simulation; * Computational Drug Discovery; * Computer Science including High Performance Computing, Quantum Computing and Machine Learning. **Present Position** * Distinguished Professor (EXceptional class, PREX2) of Theoretical Chemistry, [Sorbonne Université](http://www.sorbonne-universite.fr/) (Paris, France); * Director of the [Laboratoire de Chimie Théorique, UMR 7616 Sorbonne Université & CNRS, Department of Chemistry;](http://www.lct.jussieu.fr) * Principal Investigator, [EMC2 (Extreme-scale Mathematically-based Computational Chemistry)](https://erc-emc2.eu/) ERC SyG project; * Research Adjunct Professor, [Department of Biomedical Engineering](https://www.bme.utexas.edu/), The University of Texas at Austin (USA); * Member of the [PRACE](https://prace-ri.eu/) Steering Commitee (Partnership for Advanced Computing in Europe). * Editor, [Results in Chemistry](https://www.journals.elsevier.com/results-in-chemistry) (Elsevier). **Updated Publication List and Bibliometrics :** See my [Google scholar profil](https://scholar.google.com/citations?user=z0cOrb0AAAAJ&hl=fr) or visit my webpage : [http://piquemalresearch.com/publications/](http://piquemalresearch.com/publications/ "Jean-Philip Piquemal publications") **Software development** My research team and I lead the development of the Tinker-HP molecular dynamics package ([https://tinker-hp.org](https://tinker-hp.org "Tinker-HP")) dedicated to new generation potentials (polarizable force fields and neural networks). **Professional Background** * 2023-present : Distinguished Professor (Exceptional class, PREX-2), CNU section 31, SU. * 2020-present : Member of the [PRACE](https://prace-ri.eu/) Steering Commitee (Partnership for Advanced Computing in Europe). * 2019-2023 : Distinguished Professor (Exceptional class, PREX-1), CNU section 31, SU. * 2019-present : Director [Laboratoire de Chimie Théorique (LCT)](http://www.lct.jussieu.fr), Department of Chemistry, SU & CNRS * 2019-present : Team leader: Extreme-scale Mathematically-based Computational Chemistry (EMC2), [LCT](http://www.lct.jussieu.fr), SU/CNRS. * 2019-present : PI of the [EMC2 ERC Synergy project](https://erc-emc2.eu/) (2019-2025) * 2015-present : Research Adjunct Professor, [Department of Biomedical Engineering](https://www.bme.utexas.edu/), The University of Texas at Austin (USA). * 2016-2021 : Junior Member of the [Institut Universitaire de France](https://www.iufrance.fr/) (research chair) * 2016-2019 : Full Professor (first class, PR1), CNU section 31, SU. * 2012-2019 : Team leader of the MC2 interdisciplinary project team at [ISCD](http://iscd.upmc.fr/) (Institute for Computations and data), SU. * 2012-2018 : Director of the Institut Parisien de Chimie Physique et Théorique ([IP2CT](http://www.ip2ct.upmc.fr/)), FR 2622, SU & CNRS * 2012-2018 : Team leader: research axis of LCT: «From quantum interpretative techniques to multiscale modeling». * 2011-2016 : Full Professor (second class, PR2), UPMC. * 2009-2011 : Associate Professor (Maître de Conférences - HDR), UPMC * 2006-2009 : Assistant Professor (Maître de Conférences), UPMC. * 2004-2006 : NIH Postdoctoral Visiting Fellow, [NIEHS](https://www.niehs.nih.gov), Research Triangle Park, NC, USA (group of Thomas Darden). **Education** * 2009 : Research Habilitation (HDR) in Theoretical Chemistry, UPMC. * 2004 : Ph.D. Thesis in Theoretical Chemistry, Laboratoire de Chimie Théorique, UPMC. \[[Academic Genealogy](https://academictree.org/chemistry/tree.php?pid=70959)\] * 2001 : Diplôme d'Etude Approfondie (DEA) in Computational and Theoretical Chemistry (DEA National CIT), UPMC. * 2000 : Master degree (Maîtrise) in Chemistry (major: Physical Chemistry), UPEC. Affiliations: SU= Sorbonne Université; UPMC= Université Pierre et Marie Curie (Paris 6), now SU; NIEHS= National Institute of Environmental Health Sciences; UPEC = Université Paris-Est Créteil (Paris 12); CNRS= Centre National de la Recherche Scientifique **Teaching** Theoretical Chemistry (Quantum chemistry and Molecular Simulation), Physical Chemistry, Machine Learning, Computer Science and Programming. **Selected Honors & Awards** * 2022: [HPC Innovation Excellence](https://www.hpcwire.com/off-the-wire/hyperion-research-announces-winners-of-hpc-innovation-excellence-awards/) Award. * 2022: H2020 Innovative Training Networks (ITN), Co-PI of the [PHYMOL](http://www.phymol.eu/) project (Marie Skłodowska–Curie Actions Doctoral Network on Intermolecular Interactions). * 2022: Fellow of the [Royal Society of Chemistry](https://www.rsc.org/) (FSRC, UK) * 2022: Nominated as part of the [100 french innovators of the year](https://www.lepoint.fr/sciences-nature/les-meilleurs-inventeurs-francais-sont-09-06-2022-2478893_1924.php) by the french newspaper Le Point * 2022: [i-Nov](https://www.enseignementsup-recherche.gouv.fr/fr/le-concours-i-nov-49817) innovation award (BPI France/MESRI) * 2021: [EIC-Accelerator](https://eic.ec.europa.eu/eic-funding-opportunities/eic-accelerator_en) innovation program (European Research Council) * 2020: [i-Lab](https://www.enseignementsup-recherche.gouv.fr/fr/le-concours-i-lab-49808) innovation award (BPI France/MESRI) * 2018: [ERC Synergy](https://erc.europa.eu/funding/synergy-grants), Principal Investigator, project Extreme-scale Mathematically-based Computational Chemistry (EMC2 with E. Cancès, L. Grigori and Y. Maday) * 2018: [Atos Joseph Fourier Prize](https://fr.wikipedia.org/wiki/Prix_Atos_-_Joseph_Fourier) in Numerical Simulation (1st prize) * 2018: [France-Berkeley Fund](https://fbf.berkeley.edu/) Award * 2016: Nominated as a Junior Member of the [Institut Universitaire de France](https://en.wikipedia.org/wiki/Institut_Universitaire_de_France) (junior chair 2016-2021) * 2012: Emergence-UPMC fund Award * 2011: [Wiley-International Journal of Quantum Chemistry Young Investigator Award](https://sanibelsymposium.qtp.ufl.edu/awards-poster-sizes/winners/) * 2008: [France-Canada Research Fund](https://francecanadaculture.org/france-canada-research-fund/) Award * 2004: National Institute of Health (NIH) Postdoctoral Visiting Fellowship (2004-2006) * 2001: PhD scholarship from the Ministry of Higher Education, Research and Innovation (MESRI; 2001-2004) **Industry** * Co-founder (2020) and CSO of [Qubit Pharmaceuticals](https://qubit-pharmaceuticals.com/) **Editorial Activites** * Editor: [Results in Chemistry](https://www.journals.elsevier.com/results-in-chemistry) (Elsevier). * Associate Editor: [Living Journal of Computational Molecular Science](https://www.livecomsjournal.org/), LIveCoMS (Univ. of Colorado). * Editorial Board member: [International Journal of Quantum Chemistry](https://onlinelibrary.wiley.com/journal/1097461x) (Wiley); [Frontiers in Chemistry](https://www.frontiersin.org/journals/chemistry) (Frontiers); [Interdisciplinary Sciences: Computational Life Sciences](https://link.springer.com/journal/12539) (Springer) **Scientific Societies Memberships** * Société Chimique de France (SFC) * Royal Society of Chemistry (RSC) * American Chemical Society (ACS) * Biophysical Society * Association for Computing Machinery (ACM) * Sigma Xi

Publications

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