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Predicting the degradation processes of molecules over long timescales is a key aspect of industrial materials design. However, it is made computationally challenging by the need to construct large networks of chemical reactions that are…

Chemical Physics · Physics 2025-05-02 Joe Gilkes , Mark Storr , Reinhard J. Maurer , Scott Habershon

Counterfactual explanation methods provide information on how feature values of individual observations must be changed to obtain a desired prediction. Despite the increasing amount of proposed methods in research, only a few…

Machine Learning · Statistics 2023-09-19 Susanne Dandl , Andreas Hofheinz , Martin Binder , Bernd Bischl , Giuseppe Casalicchio

The article presents a proposal to contextualize the study of movement in first courses of university physics, as a contribution to decision-making in situations of a social nature. For this, the case of the use of kinetic impact…

Physics Education · Physics 2020-12-30 Carla Hernández , Mauricio Echiburu , Fernando Humire , Edward Mosso

We propose an approach to the semantics of package management which relates it to general event structures, well-known mathematical objects used in the semantics of concurrent, nondeterministic systems. In this approach, the data of a…

Logic in Computer Science · Computer Science 2021-07-06 Gershom Bazerman

We describe an algorithm for the generation of relativistic kinematics for collision and decay processes with multiparticle final states. In the framework of this algorithm it is possible to generate different kinematics covering most of…

High Energy Physics - Phenomenology · Physics 2015-06-25 V. A. Ilyin , D. N. Kovalenko , A. E. Pukhov

The operations of linear algebra, calculus, and statistics are routinely applied to measurement scales but certain mathematical conditions must be satisfied in order for these operations to be applicable. We call attention to the conditions…

General Mathematics · Mathematics 2007-05-23 Jonathan Barzilai

Group Theory has become an invaluable tool in the physics community. Despite numerous introductory books, the subject remains challenging for beginners. Mathematica has emerged as a popular tool for research and education, offering various…

SPARKX is an open-source Python package developed to analyze simulation data from heavy-ion collision experiments. By offering a comprehensive suite of tools, SPARKX simplifies data analysis workflows, supports multiple formats such as…

Data Analysis, Statistics and Probability · Physics 2026-02-02 Nils Sass , Hendrik Roch , Niklas Götz , Renata Krupczak , Carl B. Rosenkvist

Reactive systems are systems that maintain an ongoing interaction with their environment, activated by receiving input events from the environment and producing output events in response. Modern programming languages designed to program…

Programming Languages · Computer Science 2016-11-15 Riccardo Pucella

Mathematica is a powerful application package for doing mathematics and is used almost in all branches of science. It has widespread applications ranging from quantum computation, statistical analysis, number theory, zoology, astronomy, and…

Mathematical Software · Computer Science 2015-10-29 Santanu K. Maiti

We describe a representation in a high-level transition system for policies that express a reactive behavior for the agent. We consider a target decision component that figures out what to do next and an (online) planning capability to…

Artificial Intelligence · Computer Science 2016-04-01 Zeynep G. Saribatur , Thomas Eiter

Reaction systems are a computational model inspired by the bio-chemical reactions that happen inside biological cells. They have been and currently are studied for their many nice theoretical properties. They are also a useful modeling tool…

Formal Languages and Automata Theory · Computer Science 2020-08-05 Claudio Ferretti , Alberto Leporati , Luca Manzoni , Antonio E. Porreca

Nonlinear mixed effects modeling is a powerful tool when analyzing data from several entities in an experiment. In this paper, we present NLMEModeling, a package for mixed effects modeling in Wolfram Mathematica. NLMEModeling supports mixed…

Computation · Statistics 2020-11-16 Jacob Leander , Joachim Almquist , Anna Johnning , Julia Larsson , Mats Jirstrand

Kinetic equations bridge the gap between a microscopic description and a macroscopic description of the physical reality. Due to the high dimensionality the construction of numerical methods represents a challenge and requires a careful…

Numerical Analysis · Mathematics 2013-12-02 Lorenzo Pareschi

dynamite is an R package for Bayesian inference of intensive panel (time series) data comprising multiple measurements per multiple individuals measured in time. The package supports joint modeling of multiple response variables,…

Methodology · Statistics 2026-01-21 Santtu Tikka , Jouni Helske

Motivated by recent progress on the interplay between graph theory, dynamics, and systems theory, we revisit the analysis of chemical reaction networks described by mass action kinetics. For reaction networks possessing a thermodynamic…

Optimization and Control · Mathematics 2012-06-19 Arjan van der Schaft , Shodhan Rao , Bayu Jayawardhana

Basic principles of mathematical modeling are reviewed in this book, with the focus on physics and its practical applications, and examples of selected mathematical methods are presented. Most of the models have been imported from physics…

Classical Physics · Physics 2025-07-14 Sergej Pankratow

We report on a package of routines for the computer algebra system Maple which supports the explicit determination of the geometric quantities, field equations, equations of motion, and conserved quantities of General Relativity in the…

General Relativity and Quantum Cosmology · Physics 2007-05-23 Dirk Puetzfeld

Starting from the basic ideas of mathematica, we give a detailed description about the way of linking of external programs with mathematica through proper mathlink commands. This article may be quite helpful for the beginners to start with…

Mathematical Software · Computer Science 2008-10-20 Santanu K. Maiti

A program package, which facilitates computations in the framework of Analytic approach to QCD, is developed and described in details. The package includes the explicit expressions for relevant spectral functions calculated up to the…

High Energy Physics - Phenomenology · Physics 2014-11-20 A. V. Nesterenko , C. Simolo