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As the field of automated machine learning (AutoML) advances, it becomes increasingly important to incorporate domain knowledge into these systems. We present an approach for doing so by harnessing the power of large language models (LLMs).…
Foundation models (FMs), particularly large language models (LLMs), have shown significant promise in various software engineering (SE) tasks, including code generation, debugging, and requirement refinement. Despite these advances,…
Reconfigurable architectures like Field Programmable Gate Arrays (FPGAs) have been used for accelerating computations in several domains because of their unique combination of flexibility, performance, and power efficiency. However, FPGAs…
As AI increasingly shapes daily life, energy consumption and data privacy have become pressing concerns. On-device learning trains models directly on edge devices, cutting energy consumption and safeguarding data privacy. However, the…
Scientific codes are increasingly being used in compositional settings, especially problem solving environments (PSEs). Typical compositional modeling frameworks require significant buy-in, in the form of commitment to a particular style of…
Maximizing the user-item engagement based on vectorized embeddings is a standard procedure of recent recommender models. Despite the superior performance for item recommendations, these methods however implicitly deprioritize the modeling…
Designing large-scale geological carbon capture and storage projects and ensuring safe long-term CO2 containment - as a climate change mitigation strategy - requires fast and accurate numerical simulations. These simulations involve solving…
One of the scientific objectives of the Ooty Wide Field Array(OWFA) is to observe the redshifted HI emission from z ~ 3.35. Although predictions spell out optimistic outcomes in reasonable integration times, these studies were based purely…
Performance analysis is challenging as different components (e.g.,different libraries, and applications) of a complex system can interact with each other. However, few existing tools focus on understanding such interactions. To bridge this…
Transformer based architectures are recently used for the task of answering questions over tables. In order to improve the accuracy on this task, specialized pre-training techniques have been developed and applied on millions of open-domain…
Multifractal analysis (MFA) is a useful tool to systematically describe the spatial heterogeneity of both theoretical and experimental fractal patterns. One of the widely used methods for fractal analysis is box-covering. It is known to be…
A simplified model describing the PWFA (plasma wakefield acceleration) transverse instability in the form of a wake function parameterized only with an effective cavity aperture radius $a$ is benchmarked against PIC-simulations. This wake…
We present the W-SLDA Toolkit, a general-purpose software package for simulating ultracold Fermi gases within the framework of density functional theory and its time-dependent extensions. The toolkit enables fully microscopic studies of…
Transformer models are computationally costly on long sequences since regular attention has quadratic $O(n^2)$ time complexity. We introduce Wavelet-Enhanced Random Spectral Attention (WERSA), a novel mechanism of linear $O(n)$ time…
SfePy (Simple Finite Elements in Python) is a framework for solving various kinds of problems (mechanics, physics, biology, ...) described by partial differential equations in two or three space dimensions by the finite element method. The…
In many areas of science and engineering, it is a common task to infer physical fields from sparse observations. This paper presents the DAFI code intended as a flexible framework for two broad classes of such inverse problems: data…
One of the major issues in the computational mechanics is to take into account the geometrical complexity. To overcome this difficulty and to avoid the expensive mesh generation, geometrically unfitted methods, i.e. the numerical methods…
Stencil computations lie at the heart of many scientific and industrial applications. Unfortunately, stencil algorithms perform poorly on machines with cache based memory hierarchy, due to low re-use of memory accesses. This work shows that…
Feature engineering has become one of the most important steps to improve model prediction performance, and to produce quality datasets. However, this process requires non-trivial domain-knowledge which involves a time-consuming process.…
The evolution of molecular dynamics (MD) simulations has been intimately linked to that of computing hardware. For decades following the creation of MD, simulations have improved with computing power along the three principal dimensions of…