Advancements in materials play a crucial role in technological progress. However, the process of discovering and developing materials with desired properties is often impeded by substantial experimental costs, extensive resource utilization, and lengthy development periods. To address these challenges, modern approaches often employ machine learning (ML) techniques such as Bayesian Optimization (BO), which streamline the search for optimal materials by iteratively selecting experiments that are most likely to yield beneficial results. However, traditional BO methods, while beneficial, often struggle with balancing the trade-off between exploration and exploitation, leading to sub-optimal performance in material discovery processes. This paper introduces a novel Threshold-Driven UCB-EI Bayesian Optimization (TDUE-BO) method, which dynamically integrates the strengths of Upper Confidence Bound (UCB) and Expected Improvement (EI) acquisition functions to optimize the material discovery process. Unlike the classical BO, our method focuses on efficiently navigating the high-dimensional material design space (MDS). TDUE-BO begins with an exploration-focused UCB approach, ensuring a comprehensive initial sweep of the MDS. As the model gains confidence, indicated by reduced uncertainty, it transitions to the more exploitative EI method, focusing on promising areas identified earlier. The UCB-to-EI switching policy dictated guided through continuous monitoring of the model uncertainty during each step of sequential sampling results in navigating through the MDS more efficiently while ensuring rapid convergence. The effectiveness of TDUE-BO is demonstrated through its application on three different material datasets, showing significantly better approximation and optimization performance over the EI and UCB-based BO methods in terms of the RMSE scores and convergence efficiency, respectively.

Recent years have emerged a surge of interest in SNNs owing to their remarkable potential to handle time-dependent and event-driven data. The performance of SNNs hinges not only on selecting an apposite architecture and fine-tuning connection weights, similar to conventional ANNs, but also on the meticulous configuration of intrinsic structures within spiking computations. However, there has been a dearth of comprehensive studies examining the impact of intrinsic structures. Consequently, developers often find it challenging to apply a standardized configuration of SNNs across diverse datasets or tasks. This work delves deep into the intrinsic structures of SNNs. Initially, we unveil two pivotal components of intrinsic structures: the integration operation and firing-reset mechanism, by elucidating their influence on the expressivity of SNNs. Furthermore, we draw two key conclusions: the membrane time hyper-parameter is intimately linked to the eigenvalues of the integration operation, dictating the functional topology of spiking dynamics, and various hyper-parameters of the firing-reset mechanism govern the overall firing capacity of an SNN, mitigating the injection ratio or sampling density of input data. These findings elucidate why the efficacy of SNNs hinges heavily on the configuration of intrinsic structures and lead to a recommendation that enhancing the adaptability of these structures contributes to improving the overall performance and applicability of SNNs. Inspired by this recognition, we propose two feasible approaches to enhance SNN learning. These involve leveraging self-connection architectures and employing stochastic spiking neurons to augment the adaptability of the integration operation and firing-reset mechanism, respectively. We verify the effectiveness of the proposed methods from perspectives of theory and practice.

Kernel methods such as kernel ridge regression and Gaussian process regressions with Matern type kernels have been increasingly used, in particular, to fit potential energy surfaces (PES) and density functionals, and for materials informatics. When the dimensionality of the feature space is high, these methods are used with necessarily sparse data. In this regime, the optimal length parameter of a Matern-type kernel tends to become so large that the method effectively degenerates into a low-order polynomial regression and therefore loses any advantage over such regression. This is demonstrated theoretically as well as numerically on the examples of six- and fifteen-dimensional molecular PES using squared exponential and simple exponential kernels. The results shed additional light on the success of polynomial approximations such as PIP for medium size molecules and on the importance of orders-of-coupling based models for preserving the advantages of kernel methods with Matern type kernels or on the use of physically-motivated (reproducing) kernels.

Procedural content generation (PCG) can be applied to a wide variety of tasks in games, from narratives, levels and sounds, to trees and weapons. A large amount of game content is comprised of graphical assets, such as clouds, buildings or vegetation, that do not require gameplay function considerations. There is also a breadth of literature examining the procedural generation of such elements for purposes outside of games. The body of research, focused on specific methods for generating specific assets, provides a narrow view of the available possibilities. Hence, it is difficult to have a clear picture of all approaches and possibilities, with no guide for interested parties to discover possible methods and approaches for their needs, and no facility to guide them through each technique or approach to map out the process of using them. Therefore, a systematic literature review has been conducted, yielding 200 accepted papers. This paper explores state-of-the-art approaches to graphical asset generation, examining research from a wide range of applications, inside and outside of games. Informed by the literature, a conceptual framework has been derived to address the aforementioned gaps.

We introduce an autonomous system with closed-loop damping for first-order convex optimization. While, to this day, optimal rates of convergence are only achieved by non-autonomous methods via open-loop damping (e.g., Nesterov's algorithm), we show that our system is the first one featuring a closed-loop damping while exhibiting a rate arbitrarily close to the optimal one. We do so by coupling the damping and the speed of convergence of the system via a well-chosen Lyapunov function. We then derive a practical first-order algorithm called LYDIA by discretizing our system, and present numerical experiments supporting our theoretical findings.

Disaster Management is one of the most promising research areas because of its significant economic, environmental and social repercussions. This research focuses on analyzing different types of data (pre and post satellite images and twitter data) related to disaster management for in-depth analysis of location-wise emergency requirements. This research has been divided into two stages, namely, satellite image analysis and twitter data analysis followed by integration using location. The first stage involves pre and post disaster satellite image analysis of the location using multi-class land cover segmentation technique based on U-Net architecture. The second stage focuses on mapping the region with essential information about the disaster situation and immediate requirements for relief operations. The severely affected regions are demarcated and twitter data is extracted using keywords respective to that location. The extraction of situational information from a large corpus of raw tweets adopts Content Word based Tweet Summarization (COWTS) technique. An integration of these modules using real-time location-based mapping and frequency analysis technique gathers multi-dimensional information in the advent of disaster occurrence such as the Kerala and Mississippi floods that were analyzed and validated as test cases. The novelty of this research lies in the application of segmented satellite images for disaster relief using highlighted land cover changes and integration of twitter data by mapping these region-specific filters for obtaining a complete overview of the disaster.

In the realm of scientific exploration and technological advancement, the use of Artificial Intelligence (AI) has catalyzed breakthroughs across various scientific and technological domains. One such domain that has witnessed significant transformation is materials science, where AI-driven approaches is believed to have the potential to revolutionize the search for novel materials with desired properties: towards this aim, data quality remains key in determining reliability of AI-models. Clearly, the quality of data is a multifaceted issue, as it is linked to disparate aspects in data generation including the accuracy by which materials properties are either measured or computed by simulations, the state of knowledge and/or ability to control operating parameters during experiments, the different adopted protocols and metrological approaches etc. In this work, we focus on a few special aspects of data quality that - to the best of our knowledge - have been poorly discussed in the literature, despite their possible detrimental impact on the ability of AI-based models to serve as platforms for material discovery. One of these aspects pertains to data bias, and while it has been previously mentioned in other works [1, 2], we believe that we still lack quantitative detection and assessment tools. We therefore present here a potential quantitative approach to assess it. Other overlooked aspects, namely possible hidden variables and disparate data age, are also discussed.

In this paper, we show how model checking can be used to create multi-step plans for a differential drive wheeled robot so that it can avoid immediate danger. Using a small, purpose built model checking algorithm in situ we generate plans in real-time in a way that reflects the egocentric reactive response of simple biological agents. Our approach is based on chaining temporary control systems which are spawned to eliminate disturbances in the local environment that disrupt an autonomous agent from its preferred action (or resting state). The method involves a novel discretization of 2D LiDAR data which is sensitive to bounded stochastic variations in the immediate environment. We operationalise multi-step planning using invariant checking by forward depth-first search, using a cul-de-sac scenario as a first test case. Our results demonstrate that model checking can be used to plan efficient trajectories for local obstacle avoidance, improving on the performance of a reactive agent which can only plan one step. We achieve this in near real-time using no pre-computed data. While our method has limitations, we believe our approach shows promise as an avenue for the development of safe, reliable and transparent trajectory planning in the context of autonomous vehicles.

Large language models (LLMs) have the ability to perform in-context learning (ICL) of new tasks by conditioning on prompts comprising a few task examples. This work studies the problem of selecting the best examples given a candidate pool to improve ICL performance on given a test input. Existing approaches either require training with feedback from a much larger LLM or are computationally expensive. We propose a novel metric, GistScore, based on Example Gisting, a novel approach for training example retrievers for ICL using an attention bottleneck via Gisting, a recent technique for compressing task instructions. To tradeoff performance with ease of use, we experiment with both fine-tuning gist models on each dataset and multi-task training a single model on a large collection of datasets. On 21 diverse datasets spanning 9 tasks, we show that our fine-tuned models get state-of-the-art ICL performance with 20% absolute average gain over off-the-shelf retrievers and 7% over the best prior methods. Our multi-task model generalizes well out-of-the-box to new task categories, datasets, and prompt templates with retrieval speeds that are consistently thousands of times faster than the best prior training-free method.

Hybrid storage systems (HSS) use multiple different storage devices to provide high and scalable storage capacity at high performance. Recent research proposes various techniques that aim to accurately identify performance-critical data to place it in a "best-fit" storage device. Unfortunately, most of these techniques are rigid, which (1) limits their adaptivity to perform well for a wide range of workloads and storage device configurations, and (2) makes it difficult for designers to extend these techniques to different storage system configurations (e.g., with a different number or different types of storage devices) than the configuration they are designed for. We introduce Sibyl, the first technique that uses reinforcement learning for data placement in hybrid storage systems. Sibyl observes different features of the running workload as well as the storage devices to make system-aware data placement decisions. For every decision it makes, Sibyl receives a reward from the system that it uses to evaluate the long-term performance impact of its decision and continuously optimizes its data placement policy online. We implement Sibyl on real systems with various HSS configurations. Our results show that Sibyl provides 21.6%/19.9% performance improvement in a performance-oriented/cost-oriented HSS configuration compared to the best previous data placement technique. Our evaluation using an HSS configuration with three different storage devices shows that Sibyl outperforms the state-of-the-art data placement policy by 23.9%-48.2%, while significantly reducing the system architect's burden in designing a data placement mechanism that can simultaneously incorporate three storage devices. We show that Sibyl achieves 80% of the performance of an oracle policy that has complete knowledge of future access patterns while incurring a very modest storage overhead of only 124.4 KiB.