Calendar of Events
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TYC Distinguished Speaker Symposium: Modelling Surfaces & Catalysis
TYC Distinguished Speaker Symposium: Modelling Surfaces & Catalysis
Professor Joachim Sauer - Humboldt University of BerlinNext Generation Quantum Chemistry of Water in Acidic Zeolites
Professor Adrian Mulholland - University of Bristol
Multiscale modelling of biocatalysts for enzyme design, evolution and engineering
Thomas Keal - Science and Technology Facilities Council (STFC)
Recent developments in QM/MM modelling with ChemShell
Dr Edina Rosta - University College London
Dynamics, function and mechanism of phosphate processing enzymes
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MMM Hub: HPE / NVIDIA GPU Training Day
MMM Hub: HPE / NVIDIA GPU Training Day
"Tools and techniques to port codes on GPU" & "Experience from popular GPU-accelerated material science codes"
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New catalytic mechanisms in carbohydrate-active enzymes (CAZymes) unveiled by computer simulation
New catalytic mechanisms in carbohydrate-active enzymes (CAZymes) unveiled by computer simulation
Professor Carme RoviraDepartment of Inorganic and Organic Chemistry & Institute of Computational and Theoretical Chemistry (IQTCUB), University of Barcelona Join the Seminar here Abstract: Carbohydrate-active enzymes (CAZymes), such as glycoside hydrolases and glycosyltransferases, constitute the main machinery for the degradation, synthesis and modification of carbohydrates in nature. They have a myriad of industrial and biotechnological […]