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UCL Department of Biochemical Engineering

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Protein simulation group meeting

01 March 2019, 2:00 pm–3:00 pm

Laboratory flasks of liquid

UCL Biochemical Engineering are organising a meeting to talk about molecular dynamics work, all are welcome.

Event Information

Open to

All

Availability

Yes

Organiser

Cheng Zhang – UCL Department of Biochemical Engineering
02079769604

Location

Innovation Suite
Bernard Katz Building
UCL
London
WC1E 6BT
United Kingdom

Topics for dicussion include a wide range of protein tools, whether the running results or some bugs or demonstrations
•    Simulation (e.g. gromacs)
•    docking software
•    ddG (e.g. Rosetta, FoldX)
•    Aggregation prediction tools
•    MM/QM in enzyme development
•    etc.

in vitro validation
•    how the software results can be used to interpret/predict the wet lab data
e.g.
Tm for ddG
FRET for distance
NMR for excipient binding
Hydrogen–deuterium exchange for flexibility
 

About the Speaker

Cheng Zhang

at UCL