•Journal•ISSN: 2352-7110
SoftwareX
Elsevier BV
About: SoftwareX is an academic journal published by Elsevier BV. The journal publishes majorly in the area(s): Computer science & Python (programming language). It has an ISSN identifier of 2352-7110. It is also open access. Over the lifetime, 929 publications have been published receiving 22370 citations.
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TL;DR: GROMACS is one of the most widely used open-source and free software codes in chemistry, used primarily for dynamical simulations of biomolecules, and provides a rich set of calculation types.
12,985 citations
TL;DR: The libxc library as discussed by the authors is a library of exchange-correlation functionals for density-functional theory, which includes around 400 functions for the exchange, correlation, and the kinetic energy spanning more than 50 years of research.
356 citations
TL;DR: The data recorded by these instruments during their first and second observing runs are described, including the gravitational-wave strain arrays, released as time series sampled at 16384 Hz.
320 citations
TL;DR: TauFactor is a MatLab application for efficiently calculating the tortuosity factor, as well as volume fractions, surface areas and triple phase boundary densities, from image based microstructural data, without requiring high computational power.
244 citations
TL;DR: Joint density-functional theory (JDFT) as discussed by the authors is a fully-featured open-source electronic DFT software designed specifically to facilitate rapid development of new theories, models and algorithms.
208 citations