Пакет: python3-mdtraj (1.11.0-1 и други)

Връзки за python3-mdtraj

Ресурси за Debian:

Изтегляне на пакет-източник mdtraj.

Отговорници:

Външни препратки:

Начална страница [mdtraj.org]

Подобни пакети:

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.

Други пакети, свързани с python3-mdtraj

зависимости

препоръчани

предложени

enhances

dep: libc6 (>= 2.38)

GNU C Library: Shared libraries
също и виртуален пакет, предлаган от libc6-udeb
dep: libgcc-s1 (>= 3.0) [не i386]

GCC support library

dep: libgcc-s1 (>= 7) [i386]
dep: libgomp1 (>= 4.9)

GCC OpenMP (GOMP) support library
dep: libstdc++6 (>= 13.1)

GNU Standard C++ Library v3
dep: python3

interactive high-level object-oriented language (default python3 version)

dep: python3 (<< 3.13) [x32]

dep: python3 (<< 3.14) [не x32]

dep: python3 (>= 3.12~) [x32]

dep: python3 (>= 3.13~) [не x32]
dep: python3-astunparse [x32]

Пакетът не е наличен
dep: python3-networkx

tool to create, manipulate and study complex networks (Python3)
dep: python3-numpy (>= 1:1.25.0) [x32]

Python library for numerical computations (Python 3)

dep: python3-numpy (>= 2.0.0~) [не x32]
dep: python3-numpy-abi9 [x32]

виртуален пакет, предлаган от python3-numpy
dep: python3-numpy2-abi0 [не x32]

виртуален пакет, предлаган от python3-numpy

или python3-numpy-abi9

виртуален пакет, предлаган от python3-numpy
dep: python3-packaging

core utilities for python3 packages
dep: python3-pandas

data structures for "relational" or "labeled" data
dep: python3-pyparsing

alternative to creating and executing simple grammars - Python 3.x
dep: python3-scipy

scientific tools for Python 3
dep: python3-tables

Hierarchical database for Python3 based on HDF5

rec: python3-gsd

native file format for HOOMD-blue (Python 3 module)
rec: python3-netcdf4

Python 3 interface to the netCDF4 (network Common Data Form) library

sug: python-mdtraj-doc

Read, write and analyze MD trajectories in Python (documentation)

Изтегляне на python3-mdtraj

Изтегляне за всички налични архитектури
Архитектура	Версия	Големина на пакета	Големина след инсталиране	Файлове
amd64	1.11.0-1	1 040,2 кБ	4 621,0 кБ	[списък на файловете]
arm64	1.11.0-1	934,3 кБ	4 337,0 кБ	[списък на файловете]
i386	1.11.0-1	1 008,7 кБ	4 665,0 кБ	[списък на файловете]
x32 (неофициална архитектура)	1.10.0-3	941,5 кБ	3 887,0 кБ	[списък на файловете]