scholarly journals Autonomously designed free-form 2D DNA origami

2019 ◽  
Vol 5 (1) ◽  
pp. eaav0655 ◽  
Author(s):  
Hyungmin Jun ◽  
Fei Zhang ◽  
Tyson Shepherd ◽  
Sakul Ratanalert ◽  
Xiaodong Qi ◽  
...  

Scaffolded DNA origami offers the unique ability to organize molecules in nearly arbitrary spatial patterns at the nanometer scale, with wireframe designs further enabling complex 2D and 3D geometries with irregular boundaries and internal structures. The sequence design of the DNA staple strands needed to fold the long scaffold strand to the target geometry is typically performed manually, limiting the broad application of this materials design paradigm. Here, we present a fully autonomous procedure to design all DNA staple sequences needed to fold any free-form 2D scaffolded DNA origami wireframe object. Our algorithm uses wireframe edges consisting of two parallel DNA duplexes and enables the full autonomy of scaffold routing and staple sequence design with arbitrary network edge lengths and vertex angles. The application of our procedure to geometries with both regular and irregular external boundaries and variable internal structures demonstrates its broad utility for nanoscale materials science and nanotechnology.

2019 ◽  
Vol 10 (1) ◽  
Author(s):  
Hyungmin Jun ◽  
Xiao Wang ◽  
William P. Bricker ◽  
Mark Bathe

AbstractWireframe DNA origami has emerged as a powerful approach to fabricating nearly arbitrary 2D and 3D geometries at the nanometer-scale. Complex scaffold and staple routing needed to design wireframe DNA origami objects, however, render fully automated, geometry-based sequence design approaches essential for their synthesis. And wireframe DNA origami structural fidelity can be limited by wireframe edges that are composed only of one or two duplexes. Here we introduce a fully automated computational approach that programs 2D wireframe origami assemblies using honeycomb edges composed of six parallel duplexes. These wireframe assemblies show enhanced structural fidelity from electron microscopy-based measurement of programmed angles compared with identical geometries programmed using dual-duplex edges. Molecular dynamics provides additional theoretical support for the enhanced structural fidelity observed. Application of our top-down sequence design procedure to a variety of complex objects demonstrates its broad utility for programmable 2D nanoscale materials.


Author(s):  
Hyungmin Jun ◽  
Xiao Wang ◽  
William P. Bricker ◽  
Steve Jackson ◽  
Mark Bathe

ABSTRACTWireframe DNA origami assemblies can now be programmed automatically from the “top-down” using simple wireframe target geometries, or meshes, in 2D and 3D geometries using either rigid, six-helix bundle (6HB) or more compliant, two-helix bundle (2HB or DX) edges. While these assemblies have numerous applications in nanoscale materials fabrication due to their nanoscale spatial addressability and high degree of customization, no easy-to-use graphical user interface software yet exists to deploy these algorithmic approaches within a single, stand-alone interface. Here, we present ATHENA, an open-source software package with a graphical user interface that automatically renders single-stranded DNA scaffold routing and staple strand sequences for any target wireframe DNA origami in 2D or 3D using 2HB or 6HB edges. ATHENA enables external editing of sequences using the popular tool caDNAno, demonstrated here using asymmetric nanoscale positioning of gold nanoparticles, as well as atomic-level models for molecular dynamics, coarse-grained dynamics, or other computational chemistry simulation approaches. We anticipate ATHENA will significantly reduce the barrier for non-specialists to perform wireframe DNA origami sequence design and fabrication for custom applications in materials science, nanotechnology, therapeutics, and other areas.


2020 ◽  
Vol 66 (4) ◽  
pp. 773-793 ◽  
Author(s):  
Arman Shojaei ◽  
Alexander Hermann ◽  
Pablo Seleson ◽  
Christian J. Cyron

Abstract Diffusion-type problems in (nearly) unbounded domains play important roles in various fields of fluid dynamics, biology, and materials science. The aim of this paper is to construct accurate absorbing boundary conditions (ABCs) suitable for classical (local) as well as nonlocal peridynamic (PD) diffusion models. The main focus of the present study is on the PD diffusion formulation. The majority of the PD diffusion models proposed so far are applied to bounded domains only. In this study, we propose an effective way to handle unbounded domains both with PD and classical diffusion models. For the former, we employ a meshfree discretization, whereas for the latter the finite element method (FEM) is employed. The proposed ABCs are time-dependent and Dirichlet-type, making the approach easy to implement in the available models. The performance of the approach, in terms of accuracy and stability, is illustrated by numerical examples in 1D, 2D, and 3D.


Nanotechnology is the investigation of tiny designs, having size of 0.1 to 100 nm. Nano medication is a generally new field of science and innovation. Brief clarification of different sorts of drug nano frameworks is given. Nanotechnology is serving to significantly improve, even alter, numerous innovation and industry areas: data innovation, energy, natural science, medication, country security, sanitation, and transportation, among numerous others. The present nanotechnology tackles current advancement in science, physical science, materials science, and biotechnology to make novel materials that have interesting properties on the grounds that their designs are resolved on the nanometer scale. Ongoing advances in Nano science and nanotechnology plan new and inventive applications in the food business. Nanotechnology presented to be a productive strategy in numerous fields, especially the food business and the space of utilitarian food varieties. However just like the condition with the development of any original food handling innovation, food bundling material, or food fixing, extra investigations are expected to exhibit the possible advantages of nanotechnologies and designed nanomaterial intended for use in food varieties without antagonistic wellbeing impacts. Nano emulsions show various benefits over customary emulsions because of the little beads size they contain: high optical lucidity, phenomenal actual consistency against gravitational parcel and drop aggregation, and further developed bio-availability of typified materials, which make them appropriate for food applications.


2013 ◽  
Vol 13 (3) ◽  
pp. 780-800 ◽  
Author(s):  
C. H. Wu ◽  
O. M. Faltinsen ◽  
B. F. Chen

AbstractA finite difference scheme with ghost cell technique is used to study viscous fluid sloshing in 2D and 3D tanks with internal structures. The Navier-Stokes equations in a moving coordinate system are derived and they are mapped onto a time-independent and stretched domain. The staggered grid is used and the revised SIMPLEC iteration algorithm is performed. The developed numerical model is rigorously validated by extensive comparisons with reported analytical, numerical and experimental results. The present numerical results were also validated through an experiment setup with a tank excited by an inclined horizontal excitation or a tank mounted by a vertical baffle. The method is then applied to a number of problems including sloshing fluid in a 2D tank with a bottom-mounted baffle and in a 3D tank with a vertical plate. The phenomena of diagonal sloshing waves affected by a vertical plate are investigated in detail in this work. The effects of internal structures on the resonant frequency of a tank with liquid are discussed and the present developed numerical method can successfully analyze the sloshing phenomenon in 2D or 3D tanks with internal structures.


Nanoscale ◽  
2020 ◽  
Vol 12 (26) ◽  
pp. 13907-13911 ◽  
Author(s):  
Netzahualcóyotl Arroyo-Currás ◽  
Muaz Sadeia ◽  
Alexander K. Ng ◽  
Yekaterina Fyodorova ◽  
Natalie Williams ◽  
...  

Using DNA origami as the recognition element in an electrochemical biosensor enables the selective and direct detection of “mesoscale” virus-sized analytes.


Small ◽  
2010 ◽  
Vol 6 (23) ◽  
pp. 2664-2667 ◽  
Author(s):  
Akinori Kuzuya ◽  
Naohiro Koshi ◽  
Mayumi Kimura ◽  
Kentaro Numajiri ◽  
Takahiro Yamazaki ◽  
...  

2021 ◽  
Vol 49 (18) ◽  
pp. 10265-10274
Author(s):  
Hyungmin Jun ◽  
Xiao Wang ◽  
Molly F Parsons ◽  
William P Bricker ◽  
Torsten John ◽  
...  

Abstract Wireframe DNA origami assemblies can now be programmed automatically from the top-down using simple wireframe target geometries, or meshes, in 2D and 3D, using either rigid, six-helix bundle (6HB) or more compliant, two-helix bundle (DX) edges. While these assemblies have numerous applications in nanoscale materials fabrication due to their nanoscale spatial addressability and high degree of customization, no easy-to-use graphical user interface software yet exists to deploy these algorithmic approaches within a single, standalone interface. Further, top-down sequence design of 3D DX-based objects previously enabled by DAEDALUS was limited to discrete edge lengths and uniform vertex angles, limiting the scope of objects that can be designed. Here, we introduce the open-source software package ATHENA with a graphical user interface that automatically renders single-stranded DNA scaffold routing and staple strand sequences for any target wireframe DNA origami using DX or 6HB edges, including irregular, asymmetric DX-based polyhedra with variable edge lengths and vertices demonstrated experimentally, which significantly expands the set of possible 3D DNA-based assemblies that can be designed. ATHENA also enables external editing of sequences using caDNAno, demonstrated using asymmetric nanoscale positioning of gold nanoparticles, as well as providing atomic-level models for molecular dynamics, coarse-grained dynamics with oxDNA, and other computational chemistry simulation approaches.


1994 ◽  
Vol 346 ◽  
Author(s):  
Larry L. Hench

ABSTRACTMany biological systems have evolved means of controlling the architecture of inorganic-organic composites at a nanometer scale. The principles of biochemistry and materials science underlying the potential use of biochemical processing to develop new molecularly tailored materials are discussed, with emphasis on:methods of stereochemical control of the organic-inorganic interface,genetic and enzymic control of biosynthesis and biomineralization,molecular orbital modelling of bio organic-inorganic interfaces,barriers and limitations of biomimetic and hierarchical processing,examples of unique materials made with biochemical processing.needs and potential applications in human prostheses.


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