Dear Jmol Users
In our research group we have developed a web application to simulate a 
nanowire based biosensor. The application is built around a Jmol applet 
which allows the user to rotate a protein on a nanowire surface. The 
charge of the protein affects the current through the wire and this 
system can thus be used as a sensor.
During development we have received strong support from the Jmol 
community and would like to present the outcome of this effort. We 
gladly appreciate any feedback or suggestions for improvements.
The application is started by entering a PDB identifier and a pH value 
into the first form. The structure is loaded in overlay with computed pH 
dependent charges coming from the PROPKA model. On this page, the Jmol 
applet can be used to view the protein and to define its binding 
orientation. Upon submission of the form with the parameters, the server 
computes the expected sensor response.
Upcoming improvements include Ajax implementation and the possibility to 
monitor signal change over pH.

The application is hosted under
www.biofetsim.org

The authors thank the Jmol community for their support.
Martin Hediger, Luca De Vico, Jan Jensen


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