Package: autodock-vina (1.1.2-5 and others)

[ Source: autodock-vina  ]

docking of small molecules to proteins

AutoDock Vina is a program to support drug discovery, molecular docking and virtual screening of compound libraries. It offers multi-core capability, high performance and enhanced accuracy and ease of use.

The same institute also developed autodock, which is widely used.

O. Trott, A. J. Olson, AutoDock Vina: improving the speed and accuracy of docking with a new scoring function, efficient optimization and multithreading, Journal of Computational Chemistry 31 (2010) 455-461

Other Packages Related to autodock-vina

• dep: libboost-filesystem1.67.0

  filesystem operations (portable paths, iteration over directories, etc) in C++

• dep: libboost-program-options1.67.0

  program options library for C++

• dep: libboost-system1.67.0

  Operating system (e.g. diagnostics support) library

• dep: libboost-thread1.67.0

  portable C++ multi-threading

• dep: libc6 (>= 2.14) [amd64]

  GNU C Library: Shared libraries
  also a virtual package provided by libc6-udeb

  dep: libc6 (>= 2.17) [arm64]

  dep: libc6 (>= 2.4) [armhf, i386]

• dep: libgcc1 (>= 1:3.3.1) [not armhf]

  GCC support library

  dep: libgcc1 (>= 1:3.5) [armhf]

• dep: libstdc++6 (>= 5.2)

  GNU Standard C++ Library v3

• sug: autodock

  analysis of ligand binding to protein structure

• sug: autogrid

  pre-calculate binding of ligands to their receptor

Download autodock-vina

Download for all available architectures

Architecture	Version	Package Size	Installed Size	Files
amd64	1.1.2-5+b1	226.9 kB	582.0 kB	[list of files]
arm64	1.1.2-5+b1	206.1 kB	530.0 kB	[list of files]
armhf	1.1.2-5+b1	202.4 kB	396.0 kB	[list of files]
i386	1.1.2-5+b1	234.1 kB	596.0 kB	[list of files]