Ubuntu
mdanalysis package

mdanalysis 2.4.2+dfsg1-1build1 source package in Ubuntu

Changelog

mdanalysis (2.4.2+dfsg1-1build1) lunar; urgency=medium

  * No-change rebuild with Python 3.11 only

 -- Graham Inggs <email address hidden>  Wed, 15 Mar 2023 06:33:00 +0000

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Uploaded by:
Graham Inggs
Uploaded to:
Lunar
Original maintainer:
Debichem Team
Architectures:
any all
Section:
misc
Urgency:
Medium Urgency

See full publishing history Publishing

Series Pocket Published Component Section
Lunar release universe misc

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File Size SHA-256 Checksum
mdanalysis_2.4.2+dfsg1.orig.tar.xz 44.5 MiB 500281060fd0d99b8e4a5ebac2b69e54e3d4b2d60dae618d936039394e865b21
mdanalysis_2.4.2+dfsg1-1build1.debian.tar.xz 8.6 KiB 8705d217693cc8881bf2221cdf5f2f42568e2d70252e63efdae3ee2d652fdc80
mdanalysis_2.4.2+dfsg1-1build1.dsc 2.9 KiB 4608ee5344aa544870f3e6bca5aef218652d477de7c3dce310b8eb196799075b

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Binary packages built by this source

python-mdanalysis-doc: analyse molecular dynamics files and trajectories ( documentation)

 MDAnalysis is a Python library for the analysis of computer
 simulations of many-body systems at the molecular scale, spanning use
 cases from interactions of drugs with proteins to novel materials. It
 is widely used in the scientific community and is written by
 scientists for scientists.
 .
 MDAnalysis allows one to read particle-based trajectories (including
 individual coordinate frames such as biomolecules in the PDB format)
 and access the atomic coordinates through NumPy arrays. This provides
 a flexible and relatively fast framework for complex analysis tasks.
 In addition, powerful atom selection commands are implemented.
 Trajectories can also be manipulated (for instance, fit to a
 reference structure) and written out.
 .
 It works with a wide range of popular simulation packages including
 Gromacs, Amber, NAMD, CHARMM, DL_Poly, HooMD, LAMMPS and many others
 — see the lists of supported trajectory formats and topology formats.
 MDAnalysis also includes widely used analysis algorithms in the
 MDAnalysis.analysis module.
 .
 The MDAnalysis project uses an open governance model and is fiscally
 sponsored by NumFOCUS.
 .
 This is the documentation package for MDAnalysis.

python3-mdanalysis: analyse molecular dynamics files and trajectories

 MDAnalysis is a Python library for the analysis of computer
 simulations of many-body systems at the molecular scale, spanning use
 cases from interactions of drugs with proteins to novel materials. It
 is widely used in the scientific community and is written by
 scientists for scientists.
 .
 MDAnalysis allows one to read particle-based trajectories (including
 individual coordinate frames such as biomolecules in the PDB format)
 and access the atomic coordinates through NumPy arrays. This provides
 a flexible and relatively fast framework for complex analysis tasks.
 In addition, powerful atom selection commands are implemented.
 Trajectories can also be manipulated (for instance, fit to a
 reference structure) and written out.
 .
 It works with a wide range of popular simulation packages including
 Gromacs, Amber, NAMD, CHARMM, DL_Poly, HooMD, LAMMPS and many others
 — see the lists of supported trajectory formats and topology formats.
 MDAnalysis also includes widely used analysis algorithms in the
 MDAnalysis.analysis module.
 .
 The MDAnalysis project uses an open governance model and is fiscally
 sponsored by NumFOCUS.
 .
 This package installs the library for Python 3.

python3-mdanalysis-dbgsym: debug symbols for python3-mdanalysis