How to Install and Uninstall pdb2pqr Package on Kali Linux
Last updated: December 23,2024
1. Install "pdb2pqr" package
This guide covers the steps necessary to install pdb2pqr on Kali Linux
$
sudo apt update
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$
sudo apt install
pdb2pqr
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2. Uninstall "pdb2pqr" package
Please follow the steps below to uninstall pdb2pqr on Kali Linux:
$
sudo apt remove
pdb2pqr
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$
sudo apt autoclean && sudo apt autoremove
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3. Information about the pdb2pqr package on Kali Linux
Package: pdb2pqr
Version: 3.6.1+dfsg-1
Installed-Size: 31
Maintainer: Debian Med Packaging Team
Architecture: all
Depends: python3-numpy, python3-pdb2pqr, python3:any
Suggests: apbs
Size: 11464
SHA256: 4f419f8e2509e0027b492a087cede28a00e526100f36abc3bd3d3e61a26c96e2
SHA1: 1d71a8f07a238081409a5a01422881bb66794c0f
MD5sum: 968ba8dec1a8ced03fc260a10438fa88
Description: Preparation of protein structures for electrostatics calculations
PDB2PQR is a Python software package that automates many of the common
tasks of preparing structures for continuum electrostatics calculations.
It thus provides a platform-independent utility for converting protein files
in PDB format to PQR format. These tasks include:
* Adding a limited number of missing heavy atoms to biomolecular structures
* Determining side-chain pKas
* Placing missing hydrogens
* Optimizing the protein for favorable hydrogen bonding
* Assigning charge and radius parameters from a variety of force fields
Description-md5:
Homepage: https://www.poissonboltzmann.org
Section: science
Priority: optional
Filename: pool/main/p/pdb2pqr/pdb2pqr_3.6.1+dfsg-1_all.deb
Version: 3.6.1+dfsg-1
Installed-Size: 31
Maintainer: Debian Med Packaging Team
Architecture: all
Depends: python3-numpy, python3-pdb2pqr, python3:any
Suggests: apbs
Size: 11464
SHA256: 4f419f8e2509e0027b492a087cede28a00e526100f36abc3bd3d3e61a26c96e2
SHA1: 1d71a8f07a238081409a5a01422881bb66794c0f
MD5sum: 968ba8dec1a8ced03fc260a10438fa88
Description: Preparation of protein structures for electrostatics calculations
PDB2PQR is a Python software package that automates many of the common
tasks of preparing structures for continuum electrostatics calculations.
It thus provides a platform-independent utility for converting protein files
in PDB format to PQR format. These tasks include:
* Adding a limited number of missing heavy atoms to biomolecular structures
* Determining side-chain pKas
* Placing missing hydrogens
* Optimizing the protein for favorable hydrogen bonding
* Assigning charge and radius parameters from a variety of force fields
Description-md5:
Homepage: https://www.poissonboltzmann.org
Section: science
Priority: optional
Filename: pool/main/p/pdb2pqr/pdb2pqr_3.6.1+dfsg-1_all.deb