How to Install and Uninstall python3-qcengine Package on Kali Linux
Last updated: December 29,2024
1. Install "python3-qcengine" package
Learn how to install python3-qcengine on Kali Linux
$
sudo apt update
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$
sudo apt install
python3-qcengine
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2. Uninstall "python3-qcengine" package
This guide covers the steps necessary to uninstall python3-qcengine on Kali Linux:
$
sudo apt remove
python3-qcengine
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$
sudo apt autoclean && sudo apt autoremove
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3. Information about the python3-qcengine package on Kali Linux
Package: python3-qcengine
Source: qcengine
Version: 0.29.0-1
Installed-Size: 1815
Maintainer: Debichem Team
Architecture: all
Depends: python3-cpuinfo, python3-psutil, python3-pydantic (>= 1.8.2), python3-qcelemental (>= 0.23.0), python3-yaml, python3:any
Size: 218056
SHA256: adaf8881672693a7826d42d39ba97110c8ae3affefa55ba46d7286acd5a210de
SHA1: fb86422b7334d61a742ba514419f2517dd06d06b
MD5sum: 59c35767be093b0220464443e04eb229
Description: Quantum chemistry program executor and IO standardizer
QCEngine provides a wrapper to ingest and produce QCSchema for a variety of
quantum chemistry programs, most notably Psi4, NWchem, RDKit and Mopac.
.
Other supported (possibly proprietary) packages include DFTD3, MOLPRO, MPD2,
OpenMM, Q-Chem, Turbomole, xtb, CFour, GAMESS, Terachem and TorchANI.
Description-md5:
Homepage: https://github.com/MolSSI/QCEngine
Section: python
Priority: optional
Filename: pool/main/q/qcengine/python3-qcengine_0.29.0-1_all.deb
Source: qcengine
Version: 0.29.0-1
Installed-Size: 1815
Maintainer: Debichem Team
Architecture: all
Depends: python3-cpuinfo, python3-psutil, python3-pydantic (>= 1.8.2), python3-qcelemental (>= 0.23.0), python3-yaml, python3:any
Size: 218056
SHA256: adaf8881672693a7826d42d39ba97110c8ae3affefa55ba46d7286acd5a210de
SHA1: fb86422b7334d61a742ba514419f2517dd06d06b
MD5sum: 59c35767be093b0220464443e04eb229
Description: Quantum chemistry program executor and IO standardizer
QCEngine provides a wrapper to ingest and produce QCSchema for a variety of
quantum chemistry programs, most notably Psi4, NWchem, RDKit and Mopac.
.
Other supported (possibly proprietary) packages include DFTD3, MOLPRO, MPD2,
OpenMM, Q-Chem, Turbomole, xtb, CFour, GAMESS, Terachem and TorchANI.
Description-md5:
Homepage: https://github.com/MolSSI/QCEngine
Section: python
Priority: optional
Filename: pool/main/q/qcengine/python3-qcengine_0.29.0-1_all.deb