Article – Page 9 – Soft Matter Lab

Fast and Accurate Nanoparticle Characterization Using Deep-Learning-Enhanced Off-Axis Holography published in ACS Nano

Phase and amplitude signals from representative particles for testing the performance of the Deep-learning approach

Fast and Accurate Nanoparticle Characterization Using Deep-Learning-Enhanced Off-Axis Holography
Benjamin Midtvedt, Erik Olsén, Fredrik Eklund, Fredrik Höök, Caroline Beck Adiels, Giovanni Volpe, Daniel Midtvedt
ACS Nano 15(2), 2240–2250 (2021)
doi: 10.1021/acsnano.0c06902
arXiv: 2006.11154

The characterisation of the physical properties of nanoparticles in their native environment plays a central role in a wide range of fields, from nanoparticle-enhanced drug delivery to environmental nanopollution assessment. Standard optical approaches require long trajectories of nanoparticles dispersed in a medium with known viscosity to characterise their diffusion constant and, thus, their size. However, often only short trajectories are available, while the medium viscosity is unknown, e.g., in most biomedical applications. In this work, we demonstrate a label-free method to quantify size and refractive index of individual subwavelength particles using two orders of magnitude shorter trajectories than required by standard methods, and without assumptions about the physicochemical properties of the medium. We achieve this by developing a weighted average convolutional neural network to analyse the holographic images of the particles. As a proof of principle, we distinguish and quantify size and refractive index of silica and polystyrene particles without prior knowledge of solute viscosity or refractive index. As an example of an application beyond the state of the art, we demonstrate how this technique can monitor the aggregation of polystyrene nanoparticles, revealing the time-resolved dynamics of the monomer number and fractal dimension of individual subwavelength aggregates. This technique opens new possibilities for nanoparticle characterisation with a broad range of applications from biomedicine to environmental monitoring.

Enhanced force-field calibration via machine learning published in Applied Physics Reviews

Representation of a particle in a force field

Enhanced force-field calibration via machine learning
Aykut Argun, Tobias Thalheim, Stefano Bo, Frank Cichos, Giovanni Volpe
Applied Physics Reviews 7, 041404 (2020)
doi: 10.1063/5.0019105
arXiv: 2006.08963

The influence of microscopic force fields on the motion of Brownian particles plays a fundamental role in a broad range of fields, including soft matter, biophysics, and active matter. Often, the experimental calibration of these force fields relies on the analysis of the trajectories of these Brownian particles. However, such an analysis is not always straightforward, especially if the underlying force fields are non-conservative or time-varying, driving the system out of thermodynamic equilibrium. Here, we introduce a toolbox to calibrate microscopic force fields by analyzing the trajectories of a Brownian particle using machine learning, namely recurrent neural networks. We demonstrate that this machine-learning approach outperforms standard methods when characterizing the force fields generated by harmonic potentials if the available data are limited. More importantly, it provides a tool to calibrate force fields in situations for which there are no standard methods, such as non-conservative and time-varying force fields. In order to make this method readily available for other users, we provide a Python software package named DeepCalib, which can be easily personalized and optimized for specific applications.

Funding:

H2020 European Research Council (ERC) Starting Grant ComplexSwimmers (677511).

Diagnosis of a genetic disease improves with machine learning, a summary in Swedish published in Fysikaktuellt

Neural networks consist of a series of connected layers of neurons, whose connection weights are adjusted to learn how to determine the diagnosis from the input data.

A summary in Swedish of our previously published article “Virtual genetic diagnosis for familial hypercholesterolemia powered by machine learning” has been published in Fysikaktuellt, the journal of the Swedish Physical Society (Svenska fysikersamfundet).

Article: “Diagnostisering av sjukdomar förbättras med maskininlärning”, Saga Helgadottir, Giovanni Volpe and Stefano Romeo (in Swedish)

Original article: Virtual genetic diagnosis for familial hypercholesterolemia powered by machine learning

Press release:
Algoritm lär sig diagnostisera genetisk sjukdom (in Swedish)
An algorithm that learns to diagnose genetic disease (in English)

Feedback-controlled active brownian colloids with space-dependent rotational dynamics published in Nature Communications

Active Colloids with Position-Dependent Rotational Diffusivity
Miguel Angel Fernandez-Rodriguez, Fabio Grillo, Laura Alvarez, Marco Rathlef, Ivo Buttinoni, Giovanni Volpe & Lucio Isa
Nature Communications 11, 4223 (2020)
doi: 10.1038/s41467-020-17864-4
arXiv: 1911.02291

The non-thermal nature of self-propelling colloids offers new insights into non-equilibrium physics. The central mathematical model to describe their trajectories is active Brownian motion, where a particle moves with a constant speed, while randomly changing direction due to rotational diffusion. While several feedback strategies exist to achieve position-dependent velocity, the possibility of spatial and temporal control over rotational diffusion, which is inherently dictated by thermal fluctuations, remains untapped. Here, we decouple rotational diffusion from thermal fluctuations. Using external magnetic fields and discrete-time feedback loops, we tune the rotational diffusivity of active colloids above and below its thermal value at will and explore a rich range of phenomena including anomalous diffusion, directed transport, and localization. These findings add a new dimension to the control of active matter, with implications for a broad range of disciplines, from optimal transport to smart materials.

Machine learning reveals complex behaviours in optically trapped particles published in Machine Learning: Science and Technology

Illustration of a fully connected neural network with three inputs, three outputs, and three hidden layers.

Machine learning reveals complex behaviours in optically trapped particles
Isaac C. D. Lenton, Giovanni Volpe, Alexander B. Stilgoe, Timo A. Nieminen & Halina Rubinsztein-Dunlop
Machine Learning: Science and Technology, 1 045009 (2020)
doi: 10.1088/2632-2153/abae76
arXiv: 2004.08264

Since their invention in the 1980s, optical tweezers have found a wide range of applications, from biophotonics and mechanobiology to microscopy and optomechanics. Simulations of the motion of microscopic particles held by optical tweezers are often required to explore complex phenomena and to interpret experimental data. For the sake of computational efficiency, these simulations usually model the optical tweezers as an harmonic potential. However, more physically-accurate optical-scattering models are required to accurately model more onerous systems; this is especially true for optical traps generated with complex fields. Although accurate, these models tend to be prohibitively slow for problems with more than one or two degrees of freedom (DoF), which has limited their broad adoption. Here, we demonstrate that machine learning permits one to combine the speed of the harmonic model with the accuracy of optical-scattering models. Specifically, we show that a neural network can be trained to rapidly and accurately predict the optical forces acting on a microscopic particle. We demonstrate the utility of this approach on two phenomena that are prohibitively slow to accurately simulate otherwise: the escape dynamics of swelling microparticles in an optical trap, and the rotation rates of particles in a superposition of beams with opposite orbital angular momenta. Thanks to its high speed and accuracy, this method can greatly enhance the range of phenomena that can be efficiently simulated and studied.

Anisotropic dynamics of a self-assembled colloidal chain in an active bath published on Soft Matter

Bright-field microscopy image of a magnetic chain trapped at the liquid-air interface in a bacterial bath

Anisotropic dynamics of a self-assembled colloidal chain in an active bath
Mehdi Shafiei Aporvari, Mustafa Utkur, Emine Ulku Saritas, Giovanni Volpe & Joakim Stenhammar
Soft Matter, 2020, 16, 5609-5614
doi: https://doi.org/10.1039/D0SM00318B
arXiv: 2002.09961

Anisotropic macromolecules exposed to non-equilibrium (active) noise are very common in biological systems, and an accurate understanding of their anisotropic dynamics is therefore crucial. Here, we experimentally investigate the dynamics of isolated chains assembled from magnetic microparticles at a liquid–air interface and moving in an active bath consisting of motile E. coli bacteria. We investigate both the internal chain dynamics and the anisotropic center-of-mass dynamics through particle tracking. We find that both the internal and center-of-mass dynamics are greatly enhanced compared to the passive case, i.e., a system without bacteria, and that the center-of-mass diffusion coefficient D features a non-monotonic dependence as a function of the chain length. Furthermore, our results show that the relationship between the components of D parallel and perpendicular with respect to the direction of the applied magnetic field is preserved in the active bath compared to the passive case, with a higher diffusion in the parallel direction, in contrast to previous findings in the literature. We argue that this qualitative difference is due to subtle differences in the experimental geometry and conditions and the relative roles played by long-range hydrodynamic interactions and short-range collisions.

Characterisation of Physical Processes from Anomalous Diffusion Data, special issue on Journal of Physics A

Logo of the AnDi challenge.

Characterisation of Physical Processes from Anomalous Diffusion Data
Guest Editors
Miguel A Garcia-March, Maciej Lewenstein, Carlo Manzo, Ralf Metzler, Gorka Muñoz-Gil, Giovanni Volpe
Journal of Physics A: Mathematical and Theoretical
URL: Special Issue on Characterisation of Physical Processes from Anomalous Diffusion Data

In many systems, stochastic transport deviates from the standard laws of Brownian motion. Determining the exponent α characterising anomalous diffusion and identifying the physical origin of this behaviour are crucial steps to understanding the nature of the systems under observation. However, the determination of these properties from the analysis of the measured trajectories is often difficult, especially when these trajectories are short, irregularly sampled, or switching between different behaviours.

Over the last years, several methods have been proposed to quantify anomalous diffusion and the underlying physical process, going beyond the classical calculation of the mean squared displacement. More recently, the advent of machine learning has produced a boost in the methods to quantify anomalous diffusion.

The AnDi challenge aims at bringing together a vibrating and multidisciplinary community of scientists working on this problem. The use of the same reference datasets will allow an unbiased assessment of the performance of methods for characterising anomalous diffusion from single trajectories. This Special Issue will report on these approaches and their performance.

The deadline for submissions will be 30th June 2021 and you can submit manuscripts through ScholarOne Manuscripts. All papers will be refereed according to the usual high standards of the journal.

Gain-Assisted Optomechanical Position Locking of Metal/Dielectric Nanoshells in Optical Potentials published on ACS Photonics

Counter-propagating laser beam intensity, represented and projected on the yz plane.

Gain-Assisted Optomechanical Position Locking of Metal/Dielectric Nanoshells in Optical Potentials
Paolo Polimeno, Francesco Patti, Melissa Infusino, Jonathan Sánchez, Maria A. Iatì, Rosalba Saija, Giovanni Volpe, Onofrio M. Maragò & Alessandro Veltri
ACS Photonics 7(5), 1262–1270 (2020)
doi: https://doi.org/10.1021/acsphotonics.0c00213

We investigate gain-assisted optical forces on dye-enriched silver nanoshell in the quasi-static limit by means of a theoretical/numerical approach. We demonstrate the onset of nonlinear optical trapping of these resonant nanostructures in a counter-propagating Gaussian beam configuration. We study the optical forces and trapping behavior as a function of wavelength, particle gain level, and laser power. We support the theoretical analysis with Brownian dynamics simulations that show how particle position locking is achieved at high gains in extended optical trapping potentials. Finally, for wavelengths blue-detuned with respect to the plasmon-enhanced resonance, we observe particle channeling by the standing wave antinodes due to gradient force reversal. This work opens perspectives for gain-assisted optomechanics where nonlinear optical forces are finely tuned to efficiently trap, manipulate, channel, and deliver an externally controlled nanophotonic system.

Ordering of Binary Colloidal Crystals by Random Potentials published on Soft Matter

Ordering of Binary Colloidal Crystals by Random Potentials
André S. Nunes, Sabareesh K. P. Velu, Iryna Kasianiuk, Denys Kasyanyuk, Agnese Callegari, Giorgio Volpe, Margarida M. Telo da Gama, Giovanni Volpe & Nuno A. M. Araújo
Soft Matter 16, 4267-4273 (2020)
doi: https://doi.org/10.1039/D0SM00208A
arXiv: 1903.01579

Structural defects are ubiquitous in condensed matter, and not always a nuisance. For example, they underlie phenomena such as Anderson localization and hyperuniformity, and they are now being exploited to engineer novel materials. Here, we show experimentally that the density of structural defects in a 2D binary colloidal crystal can be engineered with a random potential. We generate the random potential using an optical speckle pattern, whose induced forces act strongly on one species of particles (strong particles) and weakly on the other (weak particles). Thus, the strong particles are more attracted to the randomly distributed local minima of the optical potential, leaving a trail of defects in the crystalline structure of the colloidal crystal. While, as expected, the crystalline ordering initially decreases with an increasing fraction of strong particles, the crystalline order is surprisingly recovered for sufficiently large fractions. We confirm our experimental results with particle-based simulations, which permit us to elucidate how this non-monotonic behavior results from the competition between the particle-potential and particle-particle interactions.

AnDi: The Anomalous Diffusion Challenge on ArXiv

Logo of the AnDi challenge

AnDi: The Anomalous Diffusion Challenge
Gorka Muñoz-Gil, Giovanni Volpe, Miguel Angel Garcia-March, Ralf Metzler, Maciej Lewenstein & Carlo Manzo
arXiv: 2003.12036

The deviation from pure Brownian motion generally referred to as anomalous diffusion has received large attention in the scientific literature to describe many physical scenarios. Several methods, based on classical statistics and machine learning approaches, have been developed to characterize anomalous diffusion from experimental data, which are usually acquired as particle trajectories. With the aim to assess and compare the available methods to characterize anomalous diffusion, we have organized the Anomalous Diffusion (AnDi) Challenge (http://www.andi-challenge.org/). Specifically, the AnDi Challenge will address three different aspects of anomalous diffusion characterization, namely: (i) Inference of the anomalous diffusion exponent. (ii) Identification of the underlying diffusion model. (iii) Segmentation of trajectories. Each problem includes sub-tasks for different number of dimensions (1D, 2D and 3D). In order to compare the various methods, we have developed a dedicated open-source framework for the simulation of the anomalous diffusion trajectories that are used for the training and test datasets. The challenge was launched on March 1, 2020, and consists of three phases. Currently, the participation to the first phase is open. Submissions will be automatically evaluated and the performance of the top-scoring methods will be thoroughly analyzed and compared in an upcoming article.