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NAMD is a parallel molecular dynamics code designed for high-performance simulation of large biomolecular systems. NAMD scales to hundreds of processors on high-end parallel platforms, as well as tens of processors on lo...

The Cambridge Structural Database (CSD) contains a complete record of all published organic and metal-organic small-molecule crystal structures. The database has been in operation for over 50 years and continues to be th...

Abstract ORCA is a general‐purpose quantum chemistry program package that features virtually all modern electronic structure methods (density functional theory, many‐body perturbation and coupled cluster theories, an...

MOTIVATION: A new protocol for sequencing the messenger RNA in a cell, known as RNA-Seq, generates millions of short sequence fragments in a single run. These fragments, or 'reads', can be used to measure levels of gene ...

The Open Visualization Tool (OVITO) is a new 3D visualization software designed for post-processing atomistic data obtained from molecular dynamics or Monte Carlo simulations. Unique analysis, editing and animations func...

BACKGROUND: Correlation networks are increasingly being used in bioinformatics applications. For example, weighted gene co-expression network analysis is a systems biology method for describing the correlation patterns a...

Summary: After more than fifteen years of existence, the R package ape has continuously grown its contents, and has been used by a growing community of users. The release of version 5.0 has marked a leap towards a modern...

BACKGROUND: the analysis of microbial communities through dna sequencing brings many challenges: the integration of different types of data with methods from ecology, genetics, phylogenetics, multivariate statistics, vis...

Abstract z-Tree (Zurich Toolbox for Ready-made Economic Experiments) is a software for developing and conducting economic experiments. The software is stable and allows programming almost any kind of experiments in a sho...

Materias / palabras clave: Computer science; Artificial intelligence; Taxonomy (biology); Field (mathematics); Software deployment; Data science; Deep learning; Machine learning; Management science; Software engineering; Engineering; Botany

Materias / palabras clave: Plug-in; Scripting language; Software; Computer science; Software engineering; Transformation (genetics); Open source software; Data science; Open source; Image processing; Software evolution; Architecture

Materias / palabras clave: Computer science; Automation; Completeness (order theory); Set (abstract data type); Process (computing); Software engineering; Task (project management); Fault tree analysis; Software evolution; Factory (object-oriented...

Introduction Interactions between Continuous Predictors in Multiple Regression The Effects of Predictor Scaling on Coefficients of Regression Equations Testing and Probing Three-Way Interactions Structuring Regression Eq...

Materias / palabras clave: Electronic data capture; Workflow; Metadata; Computer science; Translational research informatics; Software deployment; Software; Translational research; Interoperability; Process (computing); Data science; Software engi...

El presente es un artículo que se elabora con los resultados de una investigación exploratoria y descriptiva realizada con la comunidad investigadora de la Universidad de Costa Rica (UCR) entre 2012 y 2013. Se diseñó...

Computer Program Abstracts The category Computer Program Abstracts provides a rapid means of communicating up-to-date information concerning both new programs or systems and significant updates to existing ones. Followin...

Agents repesent a new paradigm for developing software applications. In spite of the interest of this particular way of looking at problems, there is considerable discrepancy on exactly what is an agent and which are the...

Materias / palabras clave: software requirements, software security, software metrics, continuous software engineering, devops, public sector software systems; Science: Mathematics: Instruments and machines: Electronic computers. Computer science:...

Materias / palabras clave: mathematical modeling, numerical and analytical methods, algorithm, software; Science: Mathematics: Instruments and machines: Electronic computers. Computer science: Computer software; Technology: Electrical engineering....

Materias / palabras clave: software engineering, software architecture, software testing, distributed computing, software design, software development; Science: Mathematics: Instruments and machines: Electronic computers. Computer science: Compute...

Materias / palabras clave: communications software, communications systems, wired and wireless communications, multimedia technologies, signal processing, statistics models; Science: Mathematics: Instruments and machines: Electronic computers. Com...

Materias / palabras clave: research software, open source; Science: Mathematics: Instruments and machines: Electronic computers. Computer science: Computer software

Materias / palabras clave: computer software, open source software; Science: Mathematics: Instruments and machines: Electronic computers. Computer science: Computer software

Materias / palabras clave: software engineering, computer systems architecture, machine learning, parallel systems, computing; Science: Mathematics: Instruments and machines: Electronic computers. Computer science: Computer software