We now study the relationship between(2.2) and (3.1).

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High-energy X-ray diffraction methods can non-destructively map the 3D microstructure and associated attributes of metallic polycrystalline engineering materials in their bulk form. These methods are often combined with external stimuli such as thermo-mechanical loading to take snapshots over time of the evolving microstructure and attributes. However, the extreme data volumes and the high costs of traditional data acquisition and reduction approaches pose a barrier to quickly extracting actionable insights and improving the temporal resolution of these snapshots. Here we present a fully automated technique capable of rapidly detecting the onset of plasticity in high-energy X-ray microscopy data. Our technique is computationally faster by at least 50 times than the traditional approaches and works for data sets that are up to 9 times sparser than a full data set. This new technique leverages self-supervised image representation learning and clustering to transform massive data into compact, semantic-rich representations of visually salient characteristics (e.g., peak shapes). These characteristics can be a rapid indicator of anomalous events such as changes in diffraction peak shapes. We anticipate that this technique will provide just-in-time actionable information to drive smarter experiments that effectively deploy multi-modal X-ray diffraction methods that span many decades of length scales.

We propose \emph{regular expression inference (REI)} as a challenge for code/language modelling, and the wider machine learning community. REI is a supervised machine learning (ML) and program synthesis task, and poses the problem of finding minimal regular expressions from examples: Given two finite sets of strings $P$ and $N$ and a cost function $\text{cost}(\cdot)$, the task is to generate an expression $r$ that accepts all strings in $P$ and rejects all strings in $N$, while no other such expression $r'$ exists with $\text{cost}(r')<\text{cost}(r)$. REI has advantages as a challenge problem: (i) regular expressions are well-known, widely used, and a natural idealisation of code; (ii) REI's asymptotic worst-case complexity is well understood; (iii) REI has a small number of easy to understand parameters (e.g.~$P$ or $N$ cardinality, string lengths of examples, or the cost function); this lets us easily finetune REI-hardness; (iv) REI is an unsolved problem for deep learning based ML. Recently, an REI solver was implemented on GPUs, using program synthesis techniques. This enabled, for the first time, fast generation of minimal expressions for complex REI instances. Building on this advance, we generate and publish the first large-scale datasets for REI, and devise and evaluate several initial heuristic and machine learning baselines. We invite the community to participate and explore ML methods that learn to solve REI problems. We believe that progress in REI directly translates to code/language modelling.

Bayesian Optimization (BO) links Gaussian Process (GP) surrogates with sequential design toward optimizing expensive-to-evaluate black-box functions. Example design heuristics, or so-called acquisition functions, like expected improvement (EI), balance exploration and exploitation to furnish global solutions under stringent evaluation budgets. However, they fall short when solving for robust optima, meaning a preference for solutions in a wider domain of attraction. Robust solutions are useful when inputs are imprecisely specified, or where a series of solutions is desired. A common mathematical programming technique in such settings involves an adversarial objective, biasing a local solver away from ``sharp'' troughs. Here we propose a surrogate modeling and active learning technique called robust expected improvement (REI) that ports adversarial methodology into the BO/GP framework. After describing the methods, we illustrate and draw comparisons to several competitors on benchmark synthetic exercises and real problems of varying complexity.

This work focuses on the problem of learning disentangled representations from observational data. Given observations ${\mathbf{x}^{(i)}}$ for $i=1,...,N $ drawn from $p(\mathbf{x}|\mathbf{y})$ with generative variables $\mathbf{y}$ admitting the distribution factorization $p(\mathbf{y}) = \prod_{c} p(\mathbf{y}_c )$, we ask whether learning disentangled representations matching the space of observations with identification guarantees on the posterior $p(\mathbf{z}| \mathbf{x}, \hat{\mathbf{y}}_c)$ for each $c$, is plausible. We argue modern deep representation learning models of data matching the distributed factorization property are ill-posed with collider bias behaviour; a source of bias producing entanglement between generating variables. Under the rubric of causality, we show this issue can be explained and reconciled under the condition of identifiability; attainable under supervision or a weak-form of it. For this, we propose regularization by identification (ReI), a modular regularization engine designed to align the behavior of large scale DL models with domain knowledge. Empirical evidence shows that enforcing ReI in a variational framework results in interpretable disentangled representations equipped with generalization capabilities to out-of-distribution examples and that aligns nicely with the true expected effect from domain knowledge between generating variables and measurement apparatus.

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Objects in the world usually appear in context, participating in spatial relationships and interactions that are predictable and expected. Knowledge of these contexts can be used in the task of using a mobile camera to search for a specified object in a room. We call this the object search task. This paper is concerned with representing this knowledge in a manner facilitating its application to object search while at the same time lending itself to autonomous learning by a robot. The ability for the robot to learn such knowledge without supervision is crucial due to the vast number of possible relationships that can exist for any given set of objects. Moreover, since a robot will not have an infinite amount of time to learn, it must be able to determine an order in which to look for possible relationships so as to maximize the rate at which new knowledge is gained. In effect, there must be a "focus of interest" operator that allows the robot to choose which examples are likely to convey the most new information and should be examined first. This paper demonstrates how a representation based on statistical confidence intervals allows the construction of a system that achieves the above goals. An algorithm, based on the Highest Impact First heuristic, is presented as a means for providing a "focus of interest" with which to control the learning process, and examples are given.

Global optimization is a common task in advanced engineering. The objective function can be very expensive to calculate or measure. In particular this is the case in Computational Fluid Dynamics (CFD) where simulations are extremely expensive and time-consuming. At present, the CFD code can also generate the exact derivatives of the objective function so we can use them in our models. The long computation to evaluate the objective function and (as a rule) high dimension of the design space make the optimization process very time-consuming. Widely adopted strategy for such objective functions is to use response function methodology.