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An output of pip install virtualenv. Pip's command-line interface allows the install of Python software packages by issuing a command: pip install some-package-name. Users can also remove the package by issuing a command: pip uninstall some-package-name. pip has a feature to manage full lists of packages and corresponding version numbers ...
Changes are persisted by Cosmos DB, which makes it possible to request changes from any point in time since the creation of the container. A "Time to Live" (or TTL) can be specified at the container level to let Cosmos DB automatically delete items after a certain amount of time expressed in seconds. This countdown starts after the last update ...
Astropy is a collection of software packages written in the Python programming language and designed for use in astronomy. [2] The software is a single, free, core package for astronomical utilities due to the increasingly widespread usage of Python by astronomers, and to foster interoperability between various extant Python astronomy packages. [3]
Anaconda Cloud is a package management service by Anaconda where users can find, access, store and share public and private notebooks, environments, and Conda and PyPI packages. [52] Cloud hosts useful Python packages, notebooks and environments for a wide variety of applications.
The Python Package Index, abbreviated as PyPI (/ ˌ p aɪ p i ˈ aɪ /) and also known as the Cheese Shop (a reference to the Monty Python's Flying Circus sketch "Cheese Shop"), [2]: 8 [3]: 742 is the official third-party software repository for Python. [4] It is analogous to the CPAN repository for Perl [5]: 36 and to the CRAN repository for R.
External or with the Scilab/Matlab/Python interface. Possibility to perform complex slices. External (export to .vtk/.vtu and many others) ElmerGUI comes VTK based visualization tool (but Paraview is recommended) Yes, VTK-based GUI, Python visualizatuion library Buil-in simple plotting + External Built-in with optional Plotly and GMV export
Package License † Language Input Output ezSpectra [5] [6] Free C++ Interfaces with Q-Chem and other packages Franck-Condon factors, photoionization cross-sections, photoelectron angular distributions, magnetic properties Libwfa [7] Free C++ Interfaces with Q-Chem and MOLCAS
Perhaps in dilute solution a constant potential must be considered. As an initial step a quantum chemical COSMO [4] calculation for all molecules is performed and the results (e.g. the screening charge density) are stored in a database. In a separate step COSMO-RS uses the stored COSMO results to calculate the chemical potential of the ...