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Supported Applications

ACPYPE

  • Description

    AnteChamber PYthon Parser interfacE: A tool based in Python to use Antechamber to generate topologies for chemical compounds and to interface with others python applications like CCPN and ARIA.

  • Usage

    To list all executables provided by ACPYPE, run: $ sbgrid-list acpype Copy to clipboard

  • Installation

    Use the following command to install this title with the CLI client: $ sbgrid-cli install acpype Copy to clipboard Available operating systems: Linux 64, OS X INTEL

  • Primary Citation*

    A. W. S. d. Silva and W. F. Vranken. 2012. ACPYPE - AnteChamber PYthon Parser interfacE. BMC Research Notes. 5: 367.


    • *Full citation information available through

  • Keywords

    Computational Chemistry

  • Default Versions

    Linux 64:  2023.10.27 (1.8 GB)
    OS X INTEL:  2023.10.27 (1.2 GB)

  • Developers

    Wim F Vranken

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