Пакет: mgltools-molkit (1.5.7-3) [non-free]

[ Източник: mgltools-molkit  ]

Python classes to read and manipulate molecules

This package is part of the mgltools set of Python libraries which provide an infrastructure for the analysis of protein structures and their docking of chemical compounds.

It provides a series of functions to calculate properties of protein structures and allows performing local modifications.

Други пакети, свързани с mgltools-molkit

• dep: mgltools-bhtree

  Bhtree library extension module

• dep: mgltools-dejavu

  visualization of 3D geometry using the OpenGL with Python

• dep: mgltools-pybabel

  molecular structure file access and interpretation

• dep: mgltools-sff

  Simple Force Field for Python

• dep: python

  interactive high-level object-oriented language (Python2 version)

• dep: python-numpy

  Numerical Python adds a fast array facility to the Python language

• rec: mgltools-cmolkit

  Python classes to interpret trajectories of Gromacs

• sug: pdb2pqr

  Preparation of protein structures for electrostatics calculations

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