Protein folding, unfolding, and ligand docking by generalized-ensemble algorithms
- đ¤ Speaker: Prof. Yuko Okamoto, Department of Physics, School of Science, Nagoya University đ Website
- đ Date & Time: Friday 29 November 2013, 12:00 - 13:00
- đ Venue: Unilever Lecture Theatre, Department of Chemistry
Abstract
Generalized-ensemble algorithms are based on artificial statistical ensembles and enhance conformational sampling greatly. In this talk, I will present the latest results of our applications of generalized-ensemble algorithms to protein folding, unfolding, and ligand docking simulations.
Series This talk is part of the Extra Theoretical Chemistry Seminars series.
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Friday 29 November 2013, 12:00-13:00