How to Install and Uninstall python3-mdtraj Package on Ubuntu 21.10 (Impish Indri)

Last updated: May 14,2024

1. Install "python3-mdtraj" package

Please follow the guidelines below to install python3-mdtraj on Ubuntu 21.10 (Impish Indri)


    
        
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                sudo apt update
            
                    
    
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            $
        

        
            
                sudo apt install
            
                        
                python3-mdtraj
            
                    
    
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2. Uninstall "python3-mdtraj" package

Please follow the step by step instructions below to uninstall python3-mdtraj on Ubuntu 21.10 (Impish Indri):


    
        
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                sudo apt remove
            
                        
                python3-mdtraj
            
                    
    
    Copied


    
        
            $
        

        
            
                sudo apt autoclean && sudo apt autoremove
            
                    
    
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3. Information about the python3-mdtraj package on Ubuntu 21.10 (Impish Indri)

Package: python3-mdtraj
Architecture: amd64
Version: 1.9.5-1
Priority: optional
Section: universe/python
Source: mdtraj
Origin: Ubuntu
Maintainer: Ubuntu Developers
Original-Maintainer: Debichem Team
Bugs: https://bugs.launchpad.net/ubuntu/+filebug
Installed-Size: 4495
Depends: python3 (<< 3.10), python3 (>= 3.9~), python3-astor, python3-numpy (>= 1.6~), python3-pyparsing, python3-scipy, python3:any, libc6 (>= 2.33), libgcc-s1 (>= 3.0), libgomp1 (>= 4.9), libstdc++6 (>= 5.2), zlib1g (>= 1:1.2.0), python3-distutils, python3-networkx, python3-pandas, python3-tables
Suggests: python-mdtraj-doc
Filename: pool/universe/m/mdtraj/python3-mdtraj_1.9.5-1_amd64.deb
Size: 1039400
MD5sum: 71b652b92554b084a98c09c9c7200c26
SHA1: e49addc3f4b0889ae15fec654f30c6b868e0f5f2
SHA256: 4895972844118755853f771ad1cd334f9f00bb29d7e6dd2e6496b8ce1d77ca40
SHA512: e03d81190109781f13b5dee1d26a271bb3f5f0c758bede297c2dcbd5204468b077cffb3c88c09516d9711e3884628acf35bae6a6abe7cf6e76eeb8da21592314
Homepage: http://mdtraj.org/
Description-en: Read, write and analyze MD trajectories in Python
Read, write and analyze MD trajectories with only a few lines of
Python code.
.
MDTraj is a python library that allows users to manipulate molecular
dynamics (MD) trajectories. Features include:
* Wide MD format support, including pdb, xtc, trr, dcd, binpos,
netcdf, mdcrd, prmtop, and more.
* Extremely fast RMSD calculations (4x the speed of the original
Theobald QCP).
* Extensive analysis functions including those that compute bonds,
angles, dihedrals, hydrogen bonds, secondary structure, and NMR
observables.
* Lightweight, Pythonic API.
.
MDTraj includes a command-line application, mdconvert-mdtraj,
for converting trajectories between formats.
.
This package installs the library for Python 3, together with the
command line utilities mdconvert-mdtraj and mdinspect.
Description-md5: 04d7dbec187003c6a29c313a28d81a7b