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An easy way to define and visualize geometry for PHITS input files introduced. Suggested FitsGeo Python package helps to define surfaces as Python objects and manipulate them conveniently. VPython assists to view defined geometry…

Human-Computer Interaction · Computer Science 2020-08-11 Ivan Gordeev

Bayesian Networks (BNs) are used in various fields for modeling, prediction, and decision making. pgmpy is a python package that provides a collection of algorithms and tools to work with BNs and related models. It implements algorithms for…

Machine Learning · Computer Science 2023-04-19 Ankur Ankan , Johannes Textor

This paper introduces the Maestro library. This library for Python focuses on the design of predictive controllers for small to medium-scale energy networks. It allows non-expert users to describe multi-carrier (electricity, heat, gas)…

Systems and Control · Electrical Eng. & Systems 2020-03-23 Tomasz T. Gorecki , William Martin

Since the dynamic characteristics of knowledge graphs, many inductive knowledge graph representation learning (KGRL) works have been proposed in recent years, focusing on enabling prediction over new entities. NeuralKG-ind is the first…

Artificial Intelligence · Computer Science 2023-05-01 Wen Zhang , Zhen Yao , Mingyang Chen , Zhiwei Huang , Huajun Chen

Automatic design of organic materials requires black-box optimization in a vast chemical space. In conventional molecular design algorithms, a molecule is built as a combination of predetermined fragments. Recently, deep neural network…

Chemical Physics · Physics 2018-06-27 Xiufeng Yang , Jinzhe Zhang , Kazuki Yoshizoe , Kei Terayama , Koji Tsuda

pPython seeks to provide a parallel capability that provides good speed-up without sacrificing the ease of programming in Python by implementing partitioned global array semantics (PGAS) on top of a simple file-based messaging library…

BondGraphTools is a Python library for scripted modelling of complex multi-physics systems. In contrast to existing modelling solutions, BondGraphTools is based upon the well established bond graph methodology, provides a programming…

Systems and Control · Electrical Eng. & Systems 2019-06-27 Peter Cudmore , Peter J. Gawthrop , Michael Pan , Edmund J. Crampin

We present the API for MUSICNTWRK, a python library for pitch class set and rhythmic sequences classification and manipulation, the generation of networks in generalized music and sound spaces, deep learning algorithms for timbre…

Sound · Computer Science 2020-07-22 Marco Buongiorno Nardelli

In this paper, we present SIMAP, a novel layer integrated into deep learning models, aimed at enhancing the interpretability of the output. The SIMAP layer is an enhanced version of Simplicial-Map Neural Networks (SMNNs), an explainable…

Machine Learning · Computer Science 2024-03-25 Rocio Gonzalez-Diaz , Miguel A. Gutiérrez-Naranjo , Eduardo Paluzo-Hidalgo

Materials informatics (MI), emerging from the integration of materials science and data science, is expected to significantly accelerate material development and discovery. The data used in MI are derived from both computational and…

Materials Science · Physics 2025-04-09 Yusuke Hashimoto , Xue Jia , Hao Li , Takaaki Tomai

Modern rendering libraries provide unprecedented realism, producing real-time photorealistic 3D graphics on commodity hardware. Visual fidelity, however, comes at the cost of increased complexity and difficulty of usage, with many rendering…

Graphics · Computer Science 2020-12-08 Radu Alexandru Rosu , Sven Behnke

We present PyXtal, a new package based on the Python programming language, used to generate structures with specific symmetry and chemical compositions for both atomic and molecular systems. This soft ware provides support for various…

Materials Science · Physics 2021-10-05 Scott Fredericks , Kevin Parrish , Dean Sayre , Qiang Zhu

This paper presents the SPARE C++ library, an open source software tool conceived to build pattern recognition and soft computing systems. The library follows the requirement of the generality: most of the implemented algorithms are able to…

Computer Vision and Pattern Recognition · Computer Science 2015-02-23 Lorenzo Livi , Guido Del Vescovo , Antonello Rizzi , Fabio Massimo Frattale Mascioli

In this paper we present an open source framework developed in Python and consisting of three distinct classes designed to manipulate in a simple and intuitive way both symbolic representations of neutrosophic sets over universes of various…

Artificial Intelligence · Computer Science 2024-04-10 Giorgio Nordo , Saeid Jafari , Arif Mehmood , Bhimraj Basumatary

QMKPy provides a Python framework for modeling and solving the quadratic multiple knapsack problem (QMKP). It is primarily aimed at researchers who develop new solution algorithms for the QMKP. QMKPy therefore mostly functions as a testbed…

Other Computer Science · Computer Science 2022-12-01 Karl-Ludwig Besser , Eduard A. Jorswieck

This paper introduces PyGAD, an open-source easy-to-use Python library for building the genetic algorithm. PyGAD supports a wide range of parameters to give the user control over everything in its life cycle. This includes, but is not…

Neural and Evolutionary Computing · Computer Science 2021-06-14 Ahmed Fawzy Gad

While recent advancements in machine learning, such as LLMs, are revolutionizing software development and creative industries, they have had minimal impact on engineers designing mechanical parts, which remains largely a manual process.…

Machine Learning · Computer Science 2025-05-07 Maximilian Mews , Ansar Aynetdinov , Vivian Schiller , Peter Eisert , Alan Akbik

Signatory is a library for calculating and performing functionality related to the signature and logsignature transforms. The focus is on machine learning, and as such includes features such as CPU parallelism, GPU support, and…

Machine Learning · Computer Science 2021-02-09 Patrick Kidger , Terry Lyons

Knowledge Graphs (KGs) are increasingly adopted as a foundational technology for integrating heterogeneous data in domains such as climate science, cultural heritage, and the life sciences. Declarative mapping languages like R2RML and RML…

Databases · Computer Science 2025-05-28 Andrea Giovanni Nuzzolese

Space-filling experimental design techniques are commonly used in many computer modeling and simulation studies to explore the effects of inputs on outputs. This research presents raxpy, a Python package that leverages expressive annotation…

Mathematical Software · Computer Science 2025-01-08 Neil Ranly , Torrey Wagner