Controlling errors in the process of molecular self-assembly

Ya Meng, N. Kashyap
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Abstract

The problem of controlling errors in the process of molecular self-assembly is of central importance in biomolecular computation. The stochastic nature of the self-assembly process leads to assembly errors, i.e., deviations from ideal growth of the assembly. Many different constructions of proofreading tile sets have been proposed in the literature to reduce the effect of such assembly errors. Another major error mechanism affecting the self-assembly process in practice is that of imperfections within the tiles themselves. This source of error has, surprisingly, received little prior attention. In this work, we consider a scenario in which some small proportion of the tiles in a tile set are “malformed”. We study, through simulations, the effect of such malformed tiles on the self-assembly process within the kinetic Tile Assembly Model (kTAM). The simulation results show that some tile set constructions show greater error-resilience in the presence of malformed tiles than others. But, most notably, the snaked proodreading tile set of Chen and Goel fails to form even moderately-sized tile assemblies when malformed tiles are present. We present modifications of the snaked proofreading construction that indicate that it is possible to design tile sets that are not just robust with respect to errors intrinsic to the self-assembly process, but also with respect to malformed tiles.
分子自组装过程中的控制误差
在生物分子计算中,控制分子自组装过程中的误差是一个非常重要的问题。自装配过程的随机性导致装配误差,即偏离装配的理想生长。在文献中提出了许多不同的校对瓦集结构,以减少这种装配错误的影响。在实践中,影响自组装过程的另一个主要错误机制是瓷砖本身的缺陷。令人惊讶的是,这个错误的来源几乎没有得到事先的注意。在这项工作中,我们考虑了一个场景,在这个场景中,瓷砖集合中的一小部分瓷砖是“畸形的”。我们通过模拟研究了这种变形瓷砖对动态瓷砖组装模型(kTAM)中自组装过程的影响。仿真结果表明,在存在畸形瓦片的情况下,某些瓦片组结构比其他瓦片组结构具有更强的抗错误性。但是,最值得注意的是,当存在畸形的瓷砖时,Chen和Goel的蛇形校对瓷砖组甚至无法形成中等大小的瓷砖组合。我们提出了蛇形校对结构的修改,表明有可能设计出不仅对自组装过程固有的错误具有鲁棒性的瓦片集,而且对畸形瓦片也具有鲁棒性。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
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