2021

• Invited e-seminars: 

  • Department of Chemistry EPFL

  • Randell Centre, Kings College London

  • Department of Chemistry, Illinois Institute of Technology

  • Computational Medicine and Bioinformatics, University of Michigan

  • Department of Physics, Vanderbilt University 

  • National Research Council of Italy 

• Society of Medicines Research, "The reality of Artificial Intelligence in drug discovery" (Invited talk)​

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2020

• Folding@Home 20th Anniversary Webinar (Invited talk) 

• Global Pharma R&D AI, Data Science & Informatics Summit, Global Engage (Invited talk)

• Annual AI In Drug Development Congress, Oxford Global (Invited talk)

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2019

• BiGMax workshop on Big-Data-Driven Materials Science, Max Planck Institute for the Physics of Complex Systems, Dresden, Germany (Invited talk)

• CECAM workshop on “Progress and developments of artificial intelligence for drug design”, Genoa, Italy (Invited talk)

• Gordan Research Conference in Computer Aided Drug Discovery, Vermont, USA (Invited talk)

• International Conference on Energy Materials and Interfaces, North East Centre for Energy Materials, Newcastle, UK (Invited talk)

• Royal Society of Chemistry AI in Chemistry Workshop, Cambridge, UK (Invited talk)

• Competence Center for Computational Chemistry Workshop, Zurich, Switzerland (Invited talk)

• German Chemoinformatics Conference, Mainz, Germany (Invited talk)

• Global Pharma R&D Informatics and AI Congress, London (Invited talk)

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2018

• CECAM School on “Machine Learning in Scientific Computing”, Nierstein, Germany (Invited talk)

• CECAM/Institute of Physics of the Chinese Academy of Science School on “Understanding Molecular Simulation”, Beijing, China (Invited talk)

• "New Vistas in Molecular Thermodynamics", Humbolt Kolleg, UC Berkeley (Invited talk)

• European/German Physical Society Condensed Matter Spring Division Meeting (Invited talk)

• CECAM workshop on "Electrostatics in Concentrated Electrolytes" (co-organiser)

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2017

• CompChemKitchen, University of Oxford (Invited talk)

• User General Meeting, rdKit

• 2nd Edwards Symposium on Challenges in Soft Matter, University of Cambridge (Invited talk)er

• CECAM workshop on "Exploiting Finite Size Effect in Simulations" (Invited talk)

• Computational statistics club, Memorial Slone Kettering Cancer Center (Invited talk) 

• Physical Mathematics Seminar, MIT (Invited talk)

• Lorentz Centre workshop "Understanding Ionic Liquids on Different Length and Time Scales"

• Workshop on "anomalous screening in electrolytes", Weizmann Institute (Invited talk)

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