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Conformational Ensembles from Experimental Data
and Computer Simulations
Program Schedule
5
9:30 – 10:00
Jana Selent, Pompeu Fabra University, Spain*
Functional Dynamics of the Distal C-tail of Arrestin
10:00 – 10:30
Massimiliano Bonomi, University of Cambridge, United Kingdom*
Integrative Structural and Dynamical Biology with PLUMED-ISDB
10:30 – 11:00
Coffee Break Meitner Hall & Planck Lobby
Session IV
Interpreting X-Ray Scattering Data
Marie Skepö, Lund University, Sweden,
Chair
11:00 – 11:45
Jill Trewhella, University of Sydney, Australia
Modelling Conformational Ensembles from Small Angle Scattering
11:45 – 12:30
Jochen Hub, Georg-August University Göttingen, Germany
Bayesian Refinement of Protein Structures and Ensembles Against SAXS Data by
Using Molecular Dynamics
12:30 – 13:00
Lee Makowski, Northeastern University, USA*
Comparison of the Global Dynamics of Proteins as Assessed by WAXS and MD
13:00 – 14:00
Lunch
Restaurant
Session V
Bayesian Methods for Generating Ensembles
Martin Blackledge, Institut de Biologie Structurale, France,
Chair
14:00 – 14:45
Michael Habeck, Max Planck Institute for Biophysical Chemistry, Germany
Bayesian Modeling with Ensemble Data
14:45 – 15:30
Collin Stultz, Massachusetts Institute of Technology, USA
What Does It Mean for a Protein to be Disordered? Insights from Experiment and
Molecular Simulations
15:30 – 16:00
Simon Olsson, Freie Universität Berlin, Germany*
Bridging the Gap Between Stationary and Dynamic Data Through Augmented
Markov Models
16:00 – 16:30
Coffee Break Meitner Hall & Planck Lobby
16:30 – 18:00
Poster Session 2
Meitner Hall
18:00 – 22:00
Dinner
Restaurant & Restaurant Terrace
Monday, August 28, 2017
8:30 – 18:00
Registration/Information Planck Lobby
Session VI
Interpreting X-Ray Diffraction and EM Data
Alexandre Bonvin, Utrecht University, The Netherlands,
Chair