Big data and uncertainty quantification: statistical inference and information-theoretic techniques applied to computational chemistry

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Event details

Date 26.03.2019 03.04.2019
Hour 08:0018:00
Speaker Carsten Hartmann, BTU Cottbus-Senftenberg Fabio Nobile, EPFL Frank Pinski, University of Cincinnati Tim Sullivan, Zuse Institute Berlin
Location
Category Conferences - Seminars

An incentive to use coarse-grained models is to use them for inference and control instead of the original (often intractable) model. Since coarse-grained models are always “wrong”, questions such as inference under model misspecification or goal-oriented uncertainty quantification (e.g. for control) come into play. This workshop will address such topics, with a special focus on predictive modelling, uncertainty quantification in molecular simulation and sensitivity analysis.

26 to 29 March 2019 - CIB premises (Room GA 3 21).
1 to 3 April 2019 - CECAM premises (Room BCH 3113).

Part of the Semester : Multi-scale Mathematical Modelling and Coarse-grain Computational Chemistry

Practical information

  • General public
  • Free

Organizer

  • John Maddocks, EPFL - Christof Schütte, Freie Universität Berlin - Carsten Hartmann, BTU Cottbus-Senftenberg 

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