The use of machine learning in algorithmic trading systems is increasingly common. In a typical set-up, supervised learning is used to predict the future prices of assets, and those predictions drive a simple trading and execution strategy. This is quite effective when the predictions have sufficient signal, markets are liquid, and transaction costs are low. However, those conditions often do not hold in thinly traded financial markets and markets for differentiated assets such as real estate or vehicles. In these markets, the trading strategy must consider the long-term effects of taking positions that are relatively more difficult to change. In this work, we propose a Reinforcement Learning (RL) algorithm that trades based on signals from a learned predictive model and addresses these challenges. We test our algorithm on 20+ years of equity data from Bursa Malaysia.

Sound is a rich information medium that transmits through air; people communicate through speech and can even discern material through tapping and listening. To capture frequencies in the human hearing range, commercial microphones typically have a sampling rate of over 40kHz. These accessible acoustic technologies are not yet widely adopted for the explicit purpose of giving robots a sense of touch. Some researchers have used sound to sense tactile information, both monitoring ambient soundscape and with embedded speakers and microphones to measure sounds within structures. However, these options commonly do not provide a direct measure of steady state force, or require electronics integrated somewhere near the contact location. In this work, we present AcousTac, an acoustic tactile sensor for electronics-free force sensitive soft skin. Compliant silicone caps and plastic tubes compose the resonant chambers that emit pneumatic-driven sound measurable with a conventional off-board microphone. The resulting frequency changes depend on the external loads on the compliant end caps. We can tune each AcousTac taxel to specific force and frequency ranges, based on geometric parameters, including tube length and end-cap geometry and thus uniquely sense each taxel simultaneously in an array. We demonstrate AcousTac's functionality on two robotic systems: a 4-taxel array and a 3-taxel astrictive gripper. AcousTac is a promising concept for force sensing on soft robotic surfaces, especially in situations where electronics near the contact are not suitable. Equipping robots with tactile sensing and soft skin provides them with a sense of touch and the ability to safely interact with their surroundings.

Machine learning (ML) models deployed in healthcare systems must face data drawn from continually evolving environments. However, researchers proposing such models typically evaluate them in a time-agnostic manner, splitting datasets according to patients sampled randomly throughout the entire study time period. This work proposes the Evaluation on Medical Datasets Over Time (EMDOT) framework, which evaluates the performance of a model class across time. Inspired by the concept of backtesting, EMDOT simulates possible training procedures that practitioners might have been able to execute at each point in time and evaluates the resulting models on all future time points. Evaluating both linear and more complex models on six distinct medical data sources (tabular and imaging), we show how depending on the dataset, using all historical data may be ideal in many cases, whereas using a window of the most recent data could be advantageous in others. In datasets where models suffer from sudden degradations in performance, we investigate plausible explanations for these shocks. We release the EMDOT package to help facilitate further works in deployment-oriented evaluation over time.

Neural network-based variational Monte Carlo (NN-VMC) has emerged as a promising cutting-edge technique of ab initio quantum chemistry. However, the high computational cost of existing approaches hinders their applications in realistic chemistry problems. Here, we report the development of a new NN-VMC method that achieves a remarkable speed-up by more than one order of magnitude, thereby greatly extending the applicability of NN-VMC to larger systems. Our key design is a novel computational framework named Forward Laplacian, which computes the Laplacian associated with neural networks, the bottleneck of NN-VMC, through an efficient forward propagation process. We then demonstrate that Forward Laplacian is not only versatile but also facilitates more developments of acceleration methods across various aspects, including optimization for sparse derivative matrix and efficient neural network design. Empirically, our approach enables NN-VMC to investigate a broader range of atoms, molecules and chemical reactions for the first time, providing valuable references to other ab initio methods. The results demonstrate a great potential in applying deep learning methods to solve general quantum mechanical problems.

We present a pipeline for predicting mechanical properties of vertically-oriented carbon nanotube (CNT) forest images using a deep learning model for artificial intelligence (AI)-based materials discovery. Our approach incorporates an innovative data augmentation technique that involves the use of multi-layer synthetic (MLS) or quasi-2.5D images which are generated by blending 2D synthetic images. The MLS images more closely resemble 3D synthetic and real scanning electron microscopy (SEM) images of CNTs but without the computational cost of performing expensive 3D simulations or experiments. Mechanical properties such as stiffness and buckling load for the MLS images are estimated using a physics-based model. The proposed deep learning architecture, CNTNeXt, builds upon our previous CNTNet neural network, using a ResNeXt feature representation followed by random forest regression estimator. Our machine learning approach for predicting CNT physical properties by utilizing a blended set of synthetic images is expected to outperform single synthetic image-based learning when it comes to predicting mechanical properties of real scanning electron microscopy images. This has the potential to accelerate understanding and control of CNT forest self-assembly for diverse applications.

Large-language models (LLMs) such as GPT-4 caught the interest of many scientists. Recent studies suggested that these models could be useful in chemistry and materials science. To explore these possibilities, we organized a hackathon. This article chronicles the projects built as part of this hackathon. Participants employed LLMs for various applications, including predicting properties of molecules and materials, designing novel interfaces for tools, extracting knowledge from unstructured data, and developing new educational applications. The diverse topics and the fact that working prototypes could be generated in less than two days highlight that LLMs will profoundly impact the future of our fields. The rich collection of ideas and projects also indicates that the applications of LLMs are not limited to materials science and chemistry but offer potential benefits to a wide range of scientific disciplines.

We present a method for the control of robot swarms using two subsets of robots: a larger group of simple, oblivious robots (which we call the workers) that is governed by simple local attraction forces, and a smaller group (the guides) with sufficient mission knowledge to create and displace a desired worker formation by operating on the local forces of the workers. The guides coordinate to shape the workers like smart particles by changing their interaction parameters. We study the approach with a large scale experiment in a physics based simulator with up to 5000 robots forming three different patterns. Our experiments reveal that the approach scales well with increasing robot numbers, and presents little pattern distortion. We evaluate the approach on a physical swarm of robots that use visual inertial odometry to compute their relative positions and obtain results that are comparable with simulation. This work lays the foundation for designing and coordinating configurable smart particles, with applications in smart materials and nanomedicine.

In this study, we investigate the application of supervised machine learning algorithms for estimating the Ultimate Tensile Strength (UTS) of Polylactic Acid (PLA) specimens fabricated using the Fused Deposition Modeling (FDM) process. A total of 31 PLA specimens were prepared, with Infill Percentage, Layer Height, Print Speed, and Extrusion Temperature serving as input parameters. The primary objective was to assess the accuracy and effectiveness of four distinct supervised classification algorithms, namely Logistic Classification, Gradient Boosting Classification, Decision Tree, and K-Nearest Neighbor, in predicting the UTS of the specimens. The results revealed that while the Decision Tree and K-Nearest Neighbor algorithms both achieved an F1 score of 0.71, the KNN algorithm exhibited a higher Area Under the Curve (AUC) score of 0.79, outperforming the other algorithms. This demonstrates the superior ability of the KNN algorithm in differentiating between the two classes of ultimate tensile strength within the dataset, rendering it the most favorable choice for classification in the context of this research. This study represents the first attempt to estimate the UTS of PLA specimens using machine learning-based classification algorithms, and the findings offer valuable insights into the potential of these techniques in improving the performance and accuracy of predictive models in the domain of additive manufacturing.

Detection of Volatile Organic Compounds (VOCs) from the breath is becoming a viable route for the early detection of diseases non-invasively. This paper presents a sensor array with three metal oxide electrodes that can use machine learning methods to identify four distinct VOCs in a mixture. The metal oxide sensor array was subjected to various VOC concentrations, including ethanol, acetone, toluene and chloroform. The dataset obtained from individual gases and their mixtures were analyzed using multiple machine learning algorithms, such as Random Forest (RF), K-Nearest Neighbor (KNN), Decision Tree, Linear Regression, Logistic Regression, Naive Bayes, Linear Discriminant Analysis, Artificial Neural Network, and Support Vector Machine. KNN and RF have shown more than 99% accuracy in classifying different varying chemicals in the gas mixtures. In regression analysis, KNN has delivered the best results with R2 value of more than 0.99 and LOD of 0.012, 0.015, 0.014 and 0.025 PPM for predicting the concentrations of varying chemicals Acetone, Toluene, Ethanol, and Chloroform, respectively in complex mixtures. Therefore, it is demonstrated that the array utilizing the provided algorithms can classify and predict the concentrations of the four gases simultaneously for disease diagnosis and treatment monitoring.

The degradation of sewer pipes poses significant economical, environmental and health concerns. The maintenance of such assets requires structured plans to perform inspections, which are more efficient when structural and environmental features are considered along with the results of previous inspection reports. The development of such plans requires degradation models that can be based on statistical and machine learning methods. This work proposes a methodology to assess their suitability to plan inspections considering three dimensions: accuracy metrics, ability to produce long-term degradation curves and explainability. Results suggest that although ensemble models yield the highest accuracy, they are unable to infer the long-term degradation of the pipes, whereas the Logistic Regression offers a slightly less accurate model that is able to produce consistent degradation curves with a high explainability. A use case is presented to demonstrate this methodology and the efficiency of model-based planning compared to the current inspection plan.