DNA Nanostructures
The elegant selectivity of Watson-Crick base-pairing makes DNA an extremely useful tool for the construction of nanoscale objects and machines. Stable structures and mechanical cycles can be programmed into a system of single strands by careful choice of the sequences of bases.
Despite the experimental successes, there is no clear theoretical description of the processes involved. Our goal is to develop a coarse-grained model of DNA, detailed enough to capture the essential physics of assembly processes, yet simple enough to be applicable over long time scales. Code, user guides and examples for simulating the model can be downloaded from this site.
We are currently using the model to develop and understand walking DNA devices, in collaboration with the pioneering experimental group of Andrew Turberfield.
We are also interested in using and developing efficient algorithms to simulate our models - in particular Monte Carlo algorithms which move clusters of particles.
DNA Tweezers
A simple molecular motor in two stages of its cycle.
1.Closed configuration - the purple strand has started to bind to the green, which holds the tweezers (blue, red & yellow) in the closed configuration.
2.Open configuration - the purple strand has now almost completely removed the green, thereby opening the tweezers
Publications
Submitted to J. Chem. Phys.
Thomas E. Ouldridge
2. The effect of topology on the structure and free energy landscape of DNA kissing complexes
Submitted to J. Chem. Phys.
Flavio Romano, Alex Hudosn, Jonathan P. K. Doye, Thomas E. Ouldridge and Ard A. Louis
3. Coarse-grained modelling of DNA and DNA self-assembly
D.Phil. thesis completed at Oxford University (2011)
4. Structural, mechanical and thermodynamic properties of a coarse-grained model of DNA (arxiv)
J. Chem. Phys. 134, 085101 (2011) - image from this paper selected for the journal cover
Thomas E. Ouldridge, Ard A. Louis and Jonathan P. K. Doye
5. DNA nanotweezers studied with a coarse-grained model of DNA (arxiv)
Phys. Rev. Lett. 104, 178101 (2010)
Thomas E. Ouldridge, Ard A. Louis and Jonathan P. K. Doye
6. Extracting bulk properties of self-assembling systems from small simulations (arxiv)
J. Phys.: Condens. Matter 22, 104102 (2010)
Thomas E. Ouldridge, Ard A. Louis and Jonathan P. K. Doye
7. The self-assembly of DNA Holliday junctions studied with a minimal model (arxiv)
J. Chem. Phys. 130, 065101 (2009)
Thomas E. Ouldridge, Iain G. Johnston, Ard A. Louis and Jonathan P. K. Doye