This paper presents SCALER, a versatile free-climbing multi-limbed robot that is designed to achieve tightly coupled simultaneous locomotion and dexterous grasping. Although existing quadruped-limbed robots have shown impressive dexterous skills such as object manipulation, it is essential to balance power-intensive locomotion and dexterous grasping capabilities. We design a torso linkage and a parallel-serial limb to meet such conflicting skills that pose unique challenges in the hardware designs. SCALER employs underactuated two-fingered GOAT grippers that can mechanically adapt and offer 7 modes of grasping, enabling SCALER to traverse extreme terrains with multi-modal grasping strategies. We study the whole-body approach, where SCALER uses its body and limbs to generate additional forces for stable grasping with environments, further enhancing versatility. Furthermore, we improve the GOAT gripper actuation speed to realize more dynamic climbing in a closed-loop control fashion. With these proposed technologies, SCALER can traverse vertical, overhang, upside-down, slippery terrains, and bouldering walls with non-convex-shaped climbing holds under the Earth's gravity.

We present a new approach to robot hand design specifically suited for successfully implementing robot learning methods to accomplish tasks in daily human environments. We introduce BaRiFlex, an innovative gripper design that alleviates the issues caused by unexpected contact and collisions during robot learning, offering robustness, grasping versatility, task versatility, and simplicity to the learning processes. This achievement is enabled by the incorporation of low-inertia actuators, providing high Back-drivability, and the strategic combination of Rigid and Flexible materials which enhances versatility and the gripper's resilience against unpredicted collisions. Furthermore, the integration of flexible Fin-Ray linkages and rigid linkages allows the gripper to execute compliant grasping and precise pinching. We conducted rigorous performance tests to characterize the novel gripper's compliance, durability, grasping and task versatility, and precision. We also integrated the BaRiFlex with a 7 Degree of Freedom (DoF) Franka Emika's Panda robotic arm to evaluate its capacity to support a trial-and-error (reinforcement learning) training procedure. The results of our experimental study are then compared to those obtained using the original rigid Franka Hand and a reference Fin-Ray soft gripper, demonstrating the superior capabilities and advantages of our developed gripper system.

This paper focuses on using natural language descriptions to enhance predictive models in the chemistry field. Conventionally, chemoinformatics models are trained with extensive structured data manually extracted from the literature. In this paper, we introduce TextReact, a novel method that directly augments predictive chemistry with texts retrieved from the literature. TextReact retrieves text descriptions relevant for a given chemical reaction, and then aligns them with the molecular representation of the reaction. This alignment is enhanced via an auxiliary masked LM objective incorporated in the predictor training. We empirically validate the framework on two chemistry tasks: reaction condition recommendation and one-step retrosynthesis. By leveraging text retrieval, TextReact significantly outperforms state-of-the-art chemoinformatics models trained solely on molecular data.

Accurately modeling their mechanical response is challenging and computationally demanding, especially for inelastic behavior. To address the computational burden, we have developed a Recurrent Neural Network (RNN) model as a surrogate for meso-scale simulations. As a basis for RNN training, a mean-field model generates a comprehensive data set representing elasto-plastic behavior. Arbitrary six-dimensional time histories of strain are used to generate multiaxial stress-strain histories under random walking and cyclic loading conditions as the source and target tasks, respectively. First, the RNN model is trained for the source task. The same model is trained leveraging transfer learning for the target task, containing fewer data and sparse features because only some strain components are non-zero. The candidate model is successfully trained and validated through a grid search exploration of over 220 different RNN configurations and demonstrates accurate predictions for both source and target tasks. The results demonstrate that transfer learning could be used to train the RNN effectively under varying strain conditions and arbitrary constituents' material properties, suggesting its potential as an appropriate tool for modeling path-dependent responses in woven composites.

Recently, Large Language Models (LLMs) have made significant advancements and are now widely used across various domains. Unfortunately, there has been a rising concern that LLMs can be misused to generate harmful or malicious content. Though a line of research has focused on aligning LLMs with human values and preventing them from producing inappropriate content, such alignments are usually vulnerable and can be bypassed by alignment-breaking attacks via adversarially optimized or handcrafted jailbreaking prompts. In this work, we introduce a Robustly Aligned LLM (RA-LLM) to defend against potential alignment-breaking attacks. RA-LLM can be directly constructed upon an existing aligned LLM with a robust alignment checking function, without requiring any expensive retraining or fine-tuning process of the original LLM. Furthermore, we also provide a theoretical analysis for RA-LLM to verify its effectiveness in defending against alignment-breaking attacks. Through real-world experiments on open-source large language models, we demonstrate that RA-LLM can successfully defend against both state-of-the-art adversarial prompts and popular handcrafted jailbreaking prompts by reducing their attack success rates from nearly 100% to around 10% or less.

Researchers in natural science need reliable methods for quantifying animal behavior. Recently, numerous computer vision methods emerged to automate the process. However, observing wild species at remote locations remains a challenging task due to difficult lighting conditions and constraints on power supply and data storage. Event cameras offer unique advantages for battery-dependent remote monitoring due to their low power consumption and high dynamic range capabilities. We use this novel sensor to quantify a behavior in Chinstrap penguins called ecstatic display. We formulate the problem as a temporal action detection task, determining the start and end times of the behavior. For this purpose, we recorded a colony of breeding penguins in Antarctica during several weeks and labeled event data on 16 nests. The developed method consists of a generator of candidate time intervals (proposals) and a classifier of the actions within them. The experiments show that the event cameras' natural response to motion is effective for continuous behavior monitoring and detection, reaching a mean average precision (mAP) of 58% (which increases to 63% in good weather conditions). The results also demonstrate the robustness against various lighting conditions contained in the challenging dataset. The low-power capabilities of the event camera allows to record three times longer than with a conventional camera. This work pioneers the use of event cameras for remote wildlife observation, opening new interdisciplinary opportunities. https://tub-rip.github.io/eventpenguins/

This study presents a methodology for surrogate optimization of cyclic adsorption processes, focusing on enhancing Pressure Swing Adsorption units for carbon dioxide ($CO_{2}$) capture. We developed and implemented a multiple-input, single-output (MISO) framework comprising two deep neural network (DNN) models, predicting key process performance indicators. These models were then integrated into an optimization framework, leveraging particle swarm optimization (PSO) and statistical analysis to generate a comprehensive Pareto front representation. This approach delineated feasible operational regions (FORs) and highlighted the spectrum of optimal decision-making scenarios. A key aspect of our methodology was the evaluation of optimization effectiveness. This was accomplished by testing decision variables derived from the Pareto front against a phenomenological model, affirming the surrogate models reliability. Subsequently, the study delved into analyzing the feasible operational domains of these decision variables. A detailed correlation map was constructed to elucidate the interplay between these variables, thereby uncovering the most impactful factors influencing process behavior. The study offers a practical, insightful operational map that aids operators in pinpointing the optimal process location and prioritizing specific operational goals.

Designing civil structures such as bridges, dams or buildings is a complex task requiring many synergies from several experts. Each is responsible for different parts of the process. This is often done in a sequential manner, e.g. the structural engineer makes a design under the assumption of certain material properties (e.g. the strength class of the concrete), and then the material engineer optimizes the material with these restrictions. This paper proposes a holistic optimization procedure, which combines the concrete mixture design and structural simulations in a joint, forward workflow that we ultimately seek to invert. In this manner, new mixtures beyond standard ranges can be considered. Any design effort should account for the presence of uncertainties which can be aleatoric or epistemic as when data is used to calibrate physical models or identify models that fill missing links in the workflow. Inverting the causal relations established poses several challenges especially when these involve physics-based models which most often than not do not provide derivatives/sensitivities or when design constraints are present. To this end, we advocate Variational Optimization, with proposed extensions and appropriately chosen heuristics to overcome the aforementioned challenges. The proposed methodology is illustrated using the design of a precast concrete beam with the objective to minimize the global warming potential while satisfying a number of constraints associated with its load-bearing capacity after 28days according to the Eurocode, the demoulding time as computed by a complex nonlinear Finite Element model, and the maximum temperature during the hydration.

Construction waste hauling trucks (CWHTs), as one of the most commonly seen heavy-duty vehicles in major cities around the globe, are usually subject to a series of regulations and spatial-temporal access restrictions because they not only produce significant NOx and PM emissions but also causes on-road fugitive dust. The timely and accurate prediction of CWHTs' destinations and dwell times play a key role in effective environmental management. To address this challenge, we propose a prediction method based on an interpretable activity-based model, input-output hidden Markov model (IOHMM), and validate it on 300 CWHTs in Chengdu, China. Contextual factors are considered in the model to improve its prediction power. Results show that the IOHMM outperforms several baseline models, including Markov chains, linear regression, and long short-term memory. Factors influencing the predictability of CWHTs' transportation activities are also explored using linear regression models. Results suggest the proposed model holds promise in assisting authorities by predicting the upcoming transportation activities of CWHTs and administering intervention in a timely and effective manner.

Vitrimer is a new class of sustainable polymers with the ability of self-healing through rearrangement of dynamic covalent adaptive networks. However, a limited choice of constituent molecules restricts their property space, prohibiting full realization of their potential applications. Through a combination of molecular dynamics (MD) simulations and machine learning (ML), particularly a novel graph variational autoencoder (VAE) model, we establish a method for generating novel vitrimers and guide their inverse design based on desired glass transition temperature (Tg). We build the first vitrimer dataset of one million and calculate Tg on 8,424 of them by high-throughput MD simulations calibrated by a Gaussian process model. The proposed VAE employs dual graph encoders and a latent dimension overlapping scheme which allows for individual representation of multi-component vitrimers. By constructing a continuous latent space containing necessary information of vitrimers, we demonstrate high accuracy and efficiency of our framework in discovering novel vitrimers with desirable Tg beyond the training regime. The proposed vitrimers with reasonable synthesizability cover a wide range of Tg and broaden the potential widespread usage of vitrimeric materials.