2025
April 22: Seminar at Department of Chemistry, Princeton University
April 3: Seminar at Washington University in St. Louis
April 2: Keynote talk at Mark Robbins HPC Symposium, Johns Hopkins University
2025
Mar 10-12: Invited talk at CECAM workshop “Predicting and understanding drug-target binding kinetics via molecular simulations", Lausanne, Switzerland
2024
Dec 2-4: Invited talk at CECAM workshop “Generative Models for classical and quantum matter", Lausanne, Switzerland
Oct 10-12: Invited talk at CECAM workshop “Expanding the Impact of Molecular Simulations by Integrating Machine Learning with Statistical Mechanics", Sorrento, Italy
Sep 23: Seminar at Department of Chemistry and the Center for Applied Artificial Intelligence in Protein Dynamics, Vanderbilt University
Sep 17-19: Invited talk at CECAM workshop “Leveraging Machine Learning for Sampling Rare Events in Biomolecular Systems", Mainz, Germany
July 28-Aug 1: Plenary talk at FOMMS 2024, Snowbird, Utah
June 13: Invited talk at Montreal Summer School of ML for Drug Discovery
May 2: Seminar at Department of Chemistry, Cornell University
Apr 15-19: Invited talk at ECT workshop "Bridging scales: At the crossroads among renormalisation group, multi-scale modelling, and deep learning", Trento, Italy
Apr 10: Seminar at "Predictive Science Network" Series, AstraZeneca (virtual)
Mar 27: Seminar at Purdue University
Mar 17-21: Invited talks at ACS Spring Meeting, New Orleans
Feb 29: Seminar at Georgetown University
Feb 21: Seminar at Northeastern University
Feb 5: Seminar at University of Maryland Baltimore, Department of Biochemistry and Molecular Biology
Jan 23: Institute Colloquium at IISER Kolkata, India
Jan 17: Seminar at IIT Delhi, India
2023
Dec 17-19: Invited talk at Rutgers Stat Mech Meeting, Rutgers University
Nov 20-21: Frontiers in AI in theoretical chemistry mini-symposium, Caltech
Nov 10: Department of Chemistry Colloquium, University of Chicago
Oct 4-6: CECAM workshop on "Making the invisible protein life visible using integrative biophysical approaches", Lugano, Switzerland
Sep 19-22: DFG workshop on "Reducing complexity of nonequilibrium systems", Freiburg, Germany
Apr 19: Seminar at NIST Applied and Computational Mathematics Division (ACMD)
Feb 20: Invited talk at student organized Biophysics 101: "Incorporating Bayesian & Artificial Intelligence Approaches into Biophysics" at Biophysical Society Annual Meeting, San Diego
Jan 24: Hirschfelder Visitor Seminar at Theoretical Chemistry Institute, University of Wisconsin-Madison
Jan 17: Department Seminar at Department of Chemistry, Texas A&M University
Jan 12: Colloquium at Center for Computational Biology, Flatiron Institute, New York
2022
Nov 10: AI4Science Seminar, Chalmers University of Technology, Sweden
Oct 23-28: Invited talk at Gordon Research Conference on Protein Folding Dynamics, Ventura, CA
Oct 17: IBBR/NIST Biomolecular Measurement Division joint seminar Oct 12-14: Invited talk at CECAM Workshop "Machine Learning Meets Statistical Mechanics: Success and Future Challenges in Biosimulations", Sorrento, Italy
Sep 25-30: Invited talk at Erice school on exploring and quantifying free energy landscapes, Erice, Italy
Sep 22-24: Invited talk at Department of Atomic Energy – Board of Research in Nuclear Sciences Symposium on Current Trends in Theoretical Chemistry, Mumbai, India
Sep 5-8: Invited talk at CECAM Workshop "20 years of Metadynamics", Lausanne, Switzerland
Aug 15: Chemical Physics Seminar at California Institute of Technology, Pasadena
July 26-28: Invited talk at American Conference on Theoretical Chemistry, Palisades Tahoe
June 28-30: Invited talk at CECAM Workshop "Chasing collective variables using machine learning", Paris, France
May 22-27: Invited talk at Les Houches-TSRC Protein Dynamics workshop, Aussois, France
May 11-13: Invited talk at CECAM Workshop "Machine learning augmented sampling", Lausanne, Switzerland
May 4: Invited talk at New York Area Group for Informatics and Modeling
Apr 29: Invited talk at Deep Generative Models for Highly Structured Data (ICLR 2022 Workshop)
Apr 23: Invited talk at "Scientific Machine Learning: Foundations and Applications" conference, Translational AI Center (TrAC) at Iowa State University
Apr 22: Institute Seminar at Max Planck Institute for Polymer Research, Mainz
Apr 15: Data Institute for Societal Challenges and Department of Chemistry and Biochemistry seminar at University of Oklahoma
Mar 3: Department of Chemistry seminar at University of Texas, Austin
Feb 23: Invited talk at NSF-workshop "AI Super Resolution Simulations - From Climate Science to Cosmology", Carnegie Mellon University
Feb 19: Invited talk at Biophysical Society Theory and Computation subgroup meeting, San Francisco
2021
Dec 15-18: Co-organizer and speaker at RARE workshop, India (virtual)
Dec 11-14: Invited talk at Theoretical Chemistry Symposium, IISER Kolkata, India (virtual)
Nov 18: Department of Chemistry seminar at Columbia University
Nov 9: Physical Chemistry seminar at University of Florida, virtual
Nov 5: Colloquium at Penn Institute for Computational Science, virtual
Oct 20: Keynote speaker at "AI for Biomaterials and Drug Design symposium" in TechConnect meeting, Washington DC
Oct 7: University of Pittsburgh/Carnegie Mellon’s Joint Molecular Biophysics/Structural Biology (MBSB) Seminar, virtual
Sep 26: Invited talk at "Physical Chemistry and Chemical Biology - 2021" Conference, India, virtual
Sep 6-10: Invited talk at Lorentz Center workshop on Accelerating the understanding of rare events, virtual
Aug 30: Theoretical and Computational Biophysics Group (TCBG) seminar at University of Illinois, virtual
Aug 24: Invited talk at "ACS COMP Awards" symposium at American Chemical Society meeting, virtual
Aug 23: Invited talk at "Sequence-Structure-Dynamics-Function Relationships of Proteins" symposium at American Chemical Society meeting, virtual
Aug 19: Seminar at Scientific Machine Learning Webinar Series, Carnegie Mellon University
July 7: Statistical Biophysics Seminar at Scuola Internazionale Superiore di Studi Avanzati, Trieste, Italy
June 22: Colloquium at AI4Science, University of Amsterdam
June 14: Invited talk at Machine Learning for Chemistry & Materials Science Focused Research Program Symposium, Boston University
June 7: Physical Chemistry Seminar at University of Oregon
June 4: Seminar at Laufer Center, Stony Brook University
May 18: Seminar at Free University, Berlin
May 13: Statistical Mechanics seminar at Cambridge University
May 11: Seminar at Department of Chemistry, New York University
May 10: Invited talk at "Machine Learning in Chemical and Materials Sciences" Conference, Center for Nonlinear Studies, Los Alamos National Laboratory
May 7: Invited talk at Frontiers in Chemistry and Biology Interface Symposium (FCBIS), University of Maryland
May 5: Seminar at The Hong Kong University of Science and Technology
April 29: Seminar at Laboratory of Computational Biology, National Institutes of Health
April 28: Seminar at Department of Chemistry, Pennsylvania State University
April 15: Seminar at Department of Chemistry, Rutgers University–Camden
April 14: Invited talk and panel member at "The Future of AI in Chemistry and Drug Discovery" symposium at American Chemical Society meeting, virtual
April 13: Invited talk at "Kinetics of Macromolecular Systems: Methods and Applications" symposium at American Chemical Society meeting, virtual
April 13: Seminar at Department of Chemistry and Biochemistry, University of California, San Diego
April 6: Seminar at Department of Chemistry, Massachusetts Institute of Technology
April 5: Seminar at Chicago Center for Theoretical Chemistry, University of Chicago
Mar 15: Invited talk at "AI and Statistical/Thermal Physics" symposium at American Physical Society Meeting, virtual
Mar 12: Biophysics seminar at University of Michigan
Mar 3: Center for Biological Physics seminar at Arizona State University
Mar 2: Invited talk at "Data-Driven Model Discovery of Non-Linear Systems for Biological and Medical Applications" symposium at Society for Industrial and Applied Mathematics (SIAM) conference on computational science and engineering, virtual
2020
Dec 10: Physical Chemistry seminar, Purdue University
Dec 3: Department of Department of Mechanical and Aerospace Engineering Seminar at University of Colorado
Aug 16-Aug 17: Invited talk at ACS Multiscale Modeling Symposium, San Francisco
Jul 23-Jul 31: Invited talk at "Information Engines at the Frontiers of Nanoscale Thermodynamics" workshop at Telluride, Colorado
Jul 28-Aug 1: Invited talk at "Machine Learning and Informatics for Chemistry and Materials" workshop at Telluride, Colorado
Jun 28-Jul 2: Invited talk at "Hydrophobicity: From Theory, to Simulation, to Experiment" workshop at Telluride, Colorado
May 20: Topical Data Science Group seminar for American Physical Society (May 2020, webinar)
Apr 14: "Statistics, optimization and machine learning" seminar at University of Colorado, Boulder
Mar 24: Invited talk at ACS "Computer Simulations of Soft Matter & Interfaces: Symposium in honor of Michael Klein at 80" symposium, Philadelphia
Mar 18-19: Invited talk at "Bruce J. Berne: 80th birthday symposium", Columbia University, New York
Mar 13: Keynote lecture at student-ogranized annual Biophysics symposium at University of Michigan
Mar 3: Department of Chemistry Colloquium at Rutgers University
Feb 23-27: Invited talk at “Computational Thermodynamics and Kinetics” (CTK) symposium at TMS 2020 annual meeting, San Diego
January 9: Biophysics seminar at NIST, Gaithersburg
2019
November 13: Department of Physics Colloquium at University of Vermont
October 14-18: Invited talk at IPAM workshop on "Interpretable Learning in Physical Sciences", as a part of the long program Machine Learning for Physics and the Physics of Learning, Los Angeles
September 19: Seminar at Department of Pharmacological Sciences at the Icahn School of Medicine at Mount Sinai, New York
Aug 25-29: Invited talk at "Recent Advances in Kinase Drug Discovery: A Joint Venture Between Medicinal, Biological and Computational Chemists", American Chemical Society fall meeting, San Diego
July 10-12: Invited talk at CECAM workshop "Learning the Collective Variables of Biomolecular Processes", Paris, France
June 21: Invited talk at the annual symposium “Science@theInterface: machine learning in biology" of Institute for Biophysical Dynamics, University of Chicago
June 16-20: Invited talk at "Free energy calculations: Entering the fourth decade of adventures in Chemistry and Biophysics" workshop in Santa Fe, New Mexico
June 5-7: Invited talk at "Exploring Complex Free Energy Landscapes: Structure/Function Formation, Multiscales, and Long-timescales" workshop at Max Planck for Polymer Research in Mainz, Germany
May 23-24: Invited talk at conference on Foundational and applied data science for molecular and materials science and engineering, at Institute for Data, Intelligent Systems, and Computation (DISC), Lehigh University
May 2-4: Invited talk at CECAM workshop "Network analysis to elucidate natural system dynamics, diversity and performance", Lyon, France
March 31-April 4: ACS Symposium on "Sampling conformations and pathways in biomolecular systems - Recent developments and applications" at American Chemical Society spring meeting, Orlando (organizer)
March 25: Machine Learning seminar at Michigan State University, East Lansing
March 13: Department of Physics colloquium at University of Maryland, Baltimore County
March 11: Invited talk at "Workshop on machine learning and applications", University of Maryland, College Park
March 4-8: Invited talk at "Exploring Free Energy Landscapes in Biology and Materials Science with Advanced Algorithms" workshop at American Physical Society spring meeting, Boston
January 7-11: Invited talk at "Role of Fluctuations and Dynamics in Biomolecular Function" workshop at Telluride, Colorado
2018
Nov 10: Invited talk at the Annual Meeting of American Physical Society, Mid-Atlantic Section, College Park
Nov 5: Seminar at Department of Chemistry and Biochemistry, University of Delaware
Oct 1-3: Invited talk at CECAM/ECAM state-of-the-art workshop: Large scale activated event simulations, Vienna, Austria
July 22-27: Invited talk at Gordon Research Conference on Water and Aqueous Solutions, New Hampshire
May 15-20: Invited talk at "Exploring and quantifying rough free energy landscapes" at International School of Statistical Physics, Erice, Sicily, Italy
May 14-18: Invited talk at "Workshop on free energy methods, kinetics and markov state models in drug design" at Novartis Institutes for Biomedical Research, Boston
April 25: Seminar at Computer-Aided Drug Design Center, School of Pharmacy, University of Maryland, Baltimore
March 12: HHMI Catalyst Seminar, University of Maryland
March 9: Seminar at Department of Chemistry and Biochemistry, Montana State University, Bozeman
March 7: Seminar at Center for Scientific Computation and Mathematical Modeling, University of Maryland, College Park
Feb 16: Seminar at NCI-UMD Annual Symposium for Integrative Cancer Research
Feb 5 : Seminar at Laboratory for Computational Biology, NIH
2017 and earlier
Dec 7-10 2017: I co-organized and gave a talk at the RARE 2017 International Conference in Agra, India
Nov 15 2017: Seminar at Department of Chemical Engineering, IIT Bombay, India
Nov 10: Seminar at Indian Institute of Technology, Hyderabad
Nov 9 2017: Seminar at the TIFR Center for Interdisciplinary Sciences, Hyderabad, India
Nov 7 2017: Seminar at Theoretical Sciences Unit at JNCASR, Bangalore, India
Nov 6 2017: Seminar at Theoretical Sciences Unit at JNCASR, Bangalore, India
Nov 3 2017: Seminar at Molecular Biophysics Unit, Indian Institute of Science, Bangalore, India
Oct 23 2017: Biophysics seminar at University of Maryland, College Park
Sep 6 2017: Joint Statistical Physics/Physical Chemistry seminar at University of Maryland, College Park
Aug 20-24 2017: Invited talk at ACS Fall meeting in the symposium "Modeling and measuring protein-ligand kinetics and residence time" in Washington D.C.
Aug 3-5 2017: I attended the "Cottrell Scholars Collaborative New Faculty Workshop" in Washington D.C.
July 2017: Invited talk at "Free energy calculations: Three decades of adventure in Chemistry and Biophysics" workshop in Telluride, Colorado
May 2017: Seminar at Center for Biophysics & Computational Biology, Temple University
May 2017: Physical Chemistry student seminar at Department of Chemistry, Columbia University
Apr 2017: Invited talk at ACS Spring meeting in the symposium "Recent progress in biophysical applications of Molecular Dynamics (Symposium in honor of Bruce Berne)" in San Francisco
Oct 2016: Invited talk at "Exploring and quantifying rough free energy landscapes" at International School of Statistical Physics, Erice, Sicily, Italy
Sep 2016: Invited talk at "Bridging time scale techniques and their applications in atomistic computational science" at Max Planck Institute for Complex Systems, Dresden, Germany
Aug 2016: Invited talk at "Reaction coordinates from molecular trajectories" in Leiden, Netherlands
July 2016: Invited talk at the "Hydrophobicity: From theory, Simulation, to experiment" workshop in Telluride, Colorado
May 2016: Invited talk at "Car-Parrinello Molecular Dynamics" conference in Chicago
Mar 2016: Seminar at the Department of Chemical Engineering, University of New Hampshire, Durham
Feb 2016: Seminar at the Department of Chemistry & Biochemistry, University of Colorado, Boulder
Feb 2016: Invited talk at "International Conference on Physics and Chemistries at Hydrophobic Interfaces" at KAUST, Saudi Arabia
Jan 2016: Seminar at the Department of Chemistry & Biochemistry, University of Maryland
Nov 2015: Seminar at the Department of Materials Science, Imperial College, London
Oct 2015: Physical Chemistry Student Seminar at Columbia University
Oct 2015: Seminar at the Laufer Center for Quantitative Biology, Stony Brook University (video link)
Sep 2015: Seminar to the research group of Prof. Michele Parrinello, ETH/USI, Lugano
Sep 2015: Contributed talk at the CECAM worksop on "From trajectories to reaction co-ordinates: making sense of molecular simulation data" in Vienna
Aug 2015: Invited talk at ACS Fall meeting in the symposium "Molecular Dynamics Simulations in Drug Discovery" in Boston