Quality diversity algorithms can be used to efficiently create a diverse set of solutions to inform engineers' intuition. But quality diversity is not efficient in very expensive problems, needing 100.000s of evaluations. Even with the assistance of surrogate models, quality diversity needs 100s or even 1000s of evaluations, which can make it use infeasible. In this study we try to tackle this problem by using a pre-optimization strategy on a lower-dimensional optimization problem and then map the solutions to a higher-dimensional case. For a use case to design buildings that minimize wind nuisance, we show that we can predict flow features around 3D buildings from 2D flow features around building footprints. For a diverse set of building designs, by sampling the space of 2D footprints with a quality diversity algorithm, a predictive model can be trained that is more accurate than when trained on a set of footprints that were selected with a space-filling algorithm like the Sobol sequence. Simulating only 16 buildings in 3D, a set of 1024 building designs with low predicted wind nuisance is created. We show that we can produce better machine learning models by producing training data with quality diversity instead of using common sampling techniques. The method can bootstrap generative design in a computationally expensive 3D domain and allow engineers to sweep the design space, understanding wind nuisance in early design phases.

The FC Portugal 3D team is developed upon the structure of our previous Simulation league 2D/3D teams and our standard platform league team. Our research concerning the robot low-level skills is focused on developing behaviors that may be applied on real robots with minimal adaptation using model-based approaches. Our research on high-level soccer coordination methodologies and team playing is mainly focused on the adaptation of previously developed methodologies from our 2D soccer teams to the 3D humanoid environment and on creating new coordination methodologies based on the previously developed ones. The research-oriented development of our team has been pushing it to be one of the most competitive over the years (World champion in 2000 and Coach Champion in 2002, European champion in 2000 and 2001, Coach 2nd place in 2003 and 2004, European champion in Rescue Simulation and Simulation 3D in 2006, World Champion in Simulation 3D in Bremen 2006 and European champion in 2007, 2012, 2013, 2014 and 2015). This paper describes some of the main innovations of our 3D simulation league team during the last years. A new generic framework for reinforcement learning tasks has also been developed. The current research is focused on improving the above-mentioned framework by developing new learning algorithms to optimize low-level skills, such as running and sprinting. We are also trying to increase student contact by providing reinforcement learning assignments to be completed using our new framework, which exposes a simple interface without sharing low-level implementation details.

Swarm Intelligence algorithms have gained significant attention in recent years as a means of solving complex and non-deterministic problems. These algorithms are inspired by the collective behavior of natural creatures, and they simulate this behavior to develop intelligent agents for computational tasks. One such algorithm is Ant Colony Optimization (ACO), which is inspired by the foraging behavior of ants and their pheromone laying mechanism. ACO is used for solving difficult problems that are discrete and combinatorial in nature. Part-of-Speech (POS) tagging is a fundamental task in natural language processing that aims to assign a part-of-speech role to each word in a sentence. In this research paper, proposed a high-performance POS-tagging method based on ACO called ACO-tagger. This method achieved a high accuracy rate of 96.867%, outperforming several state-of-the-art methods. The proposed method is fast and efficient, making it a viable option for practical applications.

Energetic materials (EM) cover a wide spectrum of propellants, pyrotechnics, and explosives and are key components in military applications for propulsion and munition systems and in civilian applications such as construction and mining [1]. Heterogenous/composite EMs have complex microstructures which significantly influence--along with chemistry--the property and performance of these materials [2-8]. There is increasing research interest in controlling the microstructure of EM, to engineer their properties and performance for targeted functional specificity [9-10]. EMs are typically solid-solid composites of organic energetic crystals (commonly CHNO compounds), inclusions (i.e., metals, nanoparticles), and plastic binders. The CHNO materials are commonly categorized based on how sensitive they are to an external load/mechanical insult. They can range f rom'insensitive' (such as TATB - based EMs [11]) to'highly sensitive' (PETN-based EMs [12-13]) with others such as HMX, CL-20, and RDX ranging in between [14]. The sensitivity is closely connected with the molecular structure of these species of EMs within the CHNO family. However, when they are formed into propellants and explosives, the sensitivity is also impacted by the physical structure, composition, and formulation of the material mixtures, as reviewed by Handley et al. [1]. In other words, the design of a mixture and its microstructure can define the overall properties and performance characteristics of formed EM, thus opening the possibility of systematic methods to engineer materials by their design.

Counterfactual explanation is one branch of interpretable machine learning that produces a perturbation sample to change the model's original decision. The generated samples can act as a recommendation for end-users to achieve their desired outputs. Most of the current counterfactual explanation approaches are the gradient-based method, which can only optimize the differentiable loss functions with continuous variables. Accordingly, the gradient-free methods are proposed to handle the categorical variables, which however have several major limitations: 1) causal relationships among features are typically ignored when generating the counterfactuals, possibly resulting in impractical guidelines for decision-makers; 2) the counterfactual explanation algorithm requires a great deal of effort into parameter tuning for dertermining the optimal weight for each loss functions which must be conducted repeatedly for different datasets and settings. In this work, to address the above limitations, we propose a prototype-based counterfactual explanation framework (ProCE). ProCE is capable of preserving the causal relationship underlying the features of the counterfactual data. In addition, we design a novel gradient-free optimization based on the multi-objective genetic algorithm that generates the counterfactual explanations for the mixed-type of continuous and categorical features. Numerical experiments demonstrate that our method compares favorably with state-of-the-art methods and therefore is applicable to existing prediction models. All the source codes and data are available at \url{https://github.com/tridungduong16/multiobj-scm-cf}.

Generalizability of Functional Forms for Interatomic Potential Models Discovered by Symbolic Regression Alberto Hernandez and Tim Mueller ABSTRACT In recent years there has been great progress in the use of machine learning algorithms to develop interatomic potential models. Machine-learned potential models are typically orders of magnitude faster than density functional theory but also orders of magnitude slower than physics-derived models such as the embedded atom method. In our previous work, we used symbolic regression to develop fast, accurate and transferrable interatomic potential models for copper with novel functional forms that resemble those of the embedded atom method. To determine the extent to which the success of these forms was specific to copper, here we explore the generalizability of these models to other facecentered cubic transition metals and analyze their out-of-sample performance on several material properties. We found that these forms work particularly well on elements that are chemically similar to copper. When compared to optimized Sutton-Chen models, which have similar complexity, the functional forms discovered using symbolic regression perform better across all elements considered except gold where they have a similar performance. They perform similarly to a moderately more complex embedded atom form on properties on which they were trained, and they are more accurate on average on other properties. We attribute this improved generalized accuracy to the relative simplicity of the models discovered using symbolic regression. We discuss the implications of these results to the broader application of symbolic regression to the development of new potentials and highlight how models discovered for one element can be used to seed new searches for different elements. I. INTRODUCTION Researchers across several fields apply molecular dynamics and Monte Carlo simulations to advance the scientific understanding, discovery, and design of materials and molecules. Using these methods, the thermodynamic and kinetic properties of a material can be computed with knowledge of the potential energy surface. Ab initio methods such density functional theory [1] (DFT), which has demonstrated good predictive accuracy [2-4] across many chemistries and configurations of atoms, can be used to compute the potential energy surface, but the computational cost and non-linear scaling of these methods severely limits the time scale and number of atoms that can be practically modeled. Surrogate models, such as cluster expansions [5] and interatomic potential models (or force fields) [6-15], are normally orders of magnitude faster than ab initio methods and usually scale linearly with respect to system size. The improved speed and scaling of surrogate models enable atomistic simulations that inform the design of materials at larger time and length scales. Different types of interatomic potentials are commonly used for materials modeling.

The design of complex self-organising systems producing life-like phenomena, such as the open-ended evolution of virtual creatures, is one of the main goals of artificial life. Lenia, a family of cellular automata (CA) generalizing Conway's Game of Life to continuous space, time and states, has attracted a lot of attention because of the wide diversity of self-organizing patterns it can generate. Among those, some spatially localized patterns (SLPs) resemble life-like artificial creatures and display complex behaviors. However, those creatures are found in only a small subspace of the Lenia parameter space and are not trivial to discover, necessitating advanced search algorithms. Furthermore, each of these creatures exist only in worlds governed by specific update rules and thus cannot interact in the same one. This paper proposes as mass-conservative extension of Lenia, called Flow Lenia, that solve both of these issues. We present experiments demonstrating its effectiveness in generating SLPs with complex behaviors and show that the update rule parameters can be optimized to generate SLPs showing behaviors of interest. Finally, we show that Flow Lenia enables the integration of the parameters of the CA update rules within the CA dynamics, making them dynamic and localized, allowing for multi-species simulations, with locally coherent update rules that define properties of the emerging creatures, and that can be mixed with neighbouring rules. We argue that this paves the way for the intrinsic evolution of self-organized artificial life forms within continuous CAs.

This article offers a literature review of goalkeeper robots in the context of the RoboCupSoccer competition. The latter is one of the various league categories hosted by the RoboCup Federation, which fosters AI and Robotics with their landmark challenges. Despite the number of articles on the subject of the goalkeeper, there is a lack of studies offering a comprehensive and up-to-date analysis. We propose to provide a review of research related to goalkeepers within the RoboCupSoccer leagues in order to extract possible improvements and scientific issues. The goalkeeper, although being a specific player, has many skills in common with other players. Therefore, this review is divided into three parts: perception, cognition and action, where the perception and action parts are common to all players and the cognition part focuses on goalkeepers. The discussion will open up on the possible improvements of the developments made for these goalkeepers.

Cloud Robotics is helping to create a new generation of robots that leverage the nearly unlimited resources of large data centers (i.e., the cloud), overcoming the limitations imposed by on-board resources. Different processing power, capabilities, resource sizes, energy consumption, and so forth, make scheduling and task allocation critical components. The basic idea of task allocation and scheduling is to optimize performance by minimizing completion time, energy consumption, delays between two consecutive tasks, along with others, and maximizing resource utilization, number of completed tasks in a given time interval, and suchlike. In the past, several works have addressed various aspects of task allocation and scheduling. In this paper, we provide a comprehensive overview of task allocation and scheduling strategies and related metrics suitable for robotic network cloud systems. We discuss the issues related to allocation and scheduling methods and the limitations that need to be overcome. The literature review is organized according to three different viewpoints: Architectures and Applications, Methods and Parameters. In addition, the limitations of each method are highlighted for future research.

Recently, evolutionary computation (EC) has been promoted by machine learning, distributed computing, and big data technologies, resulting in new research directions of EC like distributed EC and surrogate-assisted EC. These advances have significantly improved the performance and the application scope of EC, but also trigger privacy leakages, such as the leakage of optimal results and surrogate model. Accordingly, evolutionary computation combined with privacy protection is becoming an emerging topic. However, privacy concerns in evolutionary computation lack a systematic exploration, especially for the object, motivation, position, and method of privacy protection. To this end, in this paper, we discuss three typical optimization paradigms (i.e., \textit{centralized optimization, distributed optimization, and data-driven optimization}) to characterize optimization modes of evolutionary computation and propose BOOM to sort out privacy concerns in evolutionary computation. Specifically, the centralized optimization paradigm allows clients to outsource optimization problems to the centralized server and obtain optimization solutions from the server. While the distributed optimization paradigm exploits the storage and computational power of distributed devices to solve optimization problems. Also, the data-driven optimization paradigm utilizes data collected in history to tackle optimization problems lacking explicit objective functions. Particularly, this paper adopts BOOM to characterize the object and motivation of privacy protection in three typical optimization paradigms and discusses potential privacy-preserving technologies balancing optimization performance and privacy guarantees in three typical optimization paradigms. Furthermore, this paper attempts to foresee some new research directions of privacy-preserving evolutionary computation.