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autodock-vina

Fork of autodock vina, from http://vina.scripps.edu/.

Binaries

Binaries (Windows, Linux) can be downloaded from repository releases.

Building from source

Dependencies

Linux

  • Get boost. Either compile from sources or use packaging manager.
    It may work fine with older versions of boost (1.5) as well.
  • Use makefiles in build/linux.

Windows (Visual Studio 2019)

  • Download and unpack Boost into dependencies/boost_1_76_0.
  • Start x64 Native Tools Command Prompt for VS 2017.
  • Navigate into dependencies/boost_1_76_0 directory.
  • Run bootstrap.bat.
  • Run b2 -a -j8 address-model=64 architecture=x86.
  • open Visual Studio solution (autodock-vina.sln) in build/windows/.
  • Build vina or vina-split project. Do not build the solution as that would run build of both project at once causing them to collide.

Change log

  • Update sources to work with Boost 1.76 and project to Visual Studio 2019
  • Update sources to work with Boost 1.67
  • Fix issue with hardcoded limit on generated models