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A key feature of collaboration in science and software development is to have a {\em log} of what and how is being done - for private use and reuse and for sharing selected parts with collaborators, which most often today are distributed…
PLUMED-GUI is an interactive environment to develop and test complex PLUMED scripts within the Visual Molecular Dynamics (VMD) environment. Computational biophysicists can take advantage of both PLUMED's rich syntax to define collective…
Mobile sensing - i.e., the ability to unobtrusively collect sensor data from built-in phone sensors - has long been a core research topic in Ubicomp. A number of technological platforms for mobile sensing have been presented over the years…
Data is a crucial raw material of this century, and the amount of data that has been created in materials science in recent years and is being created every new day is immense. Without a proper infrastructure that allows for collecting and…
The generation of large, high-quality datasets for code understanding and generation remains a significant challenge, particularly when aligning decompiled binaries with their original source code. To address this, we present CodableLLM, a…
Semantic communication serves as a novel paradigm and attracts the broad interest of researchers. One critical aspect of it is the multi-user semantic communication theory, which can further promote its application to the practical network…
In the context of high-quality asteroseismic data provided by the NASA Kepler mission, we developed a new code, termed Diamonds (high-DImensional And multi-MOdal NesteD Sampling), for fast Bayesian parameter estimation and model comparison…
There are a multitude of emerging imaging technologies that could benefit robotics. However the need for bespoke models, calibration and low-level processing represents a key barrier to their adoption. In this work we present NOCaL, Neural…
CHEMSMART (Chemistry Simulation and Modeling Automation Toolkit) is an open-source, Python-based framework designed to streamline quantum chemistry workflows for homogeneous catalysis and molecular modeling. By integrating job preparation,…
We report on experiments performed in vacuum and at cryogenic temperatures on a tri-port nano-electro-mechanical (NEMS) device. One port is a very non-linear capacitive actuation, while the two others implement the magnetomotive scheme with…
Cost-maps are used by robotic vehicles to plan collision-free paths. The cost associated with each cell in the map represents the sensed environment information which is often determined manually after several trial-and-error efforts. In…
Enhancing sampling and analyzing simulations are central issues in molecular simulation. Recently, we introduced PLUMED, an open-source plug-in that provides some of the most popular molecular dynamics (MD) codes with implementations of a…
Robot learning research is fragmented across policy families, benchmark suites, and real robots; each implementation is entangled with the others in a complex combination matrix, making it an engineering nightmare to port any single…
Large Language Models (LLMs) are increasingly utilised in software engineering, yet their ability to generate structured artefacts such as UML diagrams remains underexplored. In this work we present NOMAD, a cognitively inspired, modular…
Building a predictive model that rapidly adapts to real-time condition monitoring (CM) signals is critical for engineering systems/units. Unfortunately, many current methods suffer from a trade-off between representation power and agility…
Personalizing large language models (LLMs) is essential for delivering tailored interactions that improve user experience. Many existing personalization methods require fine-tuning LLMs for each user, rendering them prohibitively expensive…
ConsumerCheck is an open source data analysis software tailored for analysis of sensory and consumer data. Since some of the implemented methods are generic, such as PCA, PLSR and PCR, other data from other domains may also be analysed with…
The possibility of interaction between Maple and numeric compiled languages in performing extensive numeric calculations is exemplified by the Ndynamics package, a tool for studying the (chaotic) behavior of dynamical systems. Programming…
Due to recent advancements in machine learning, recommender systems use increasingly more energy for training, evaluation, and deployment. However, the recommender systems community often does not report the energy consumption of their…
Wearable sensor systems have demonstrated a great potential for real-time, objective monitoring of physiological health to support behavioral interventions. However, obtaining accurate labels in free-living environments remains difficult…