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Package: libnblib-gmx0 (2024.1-1 and others) [debports]

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GROMACS molecular dynamics sim, NB-LIB shared libraries

GROMACS is a versatile package to perform molecular dynamics, i.e. simulate the Newtonian equations of motion for systems with hundreds to millions of particles.

The goal of NB-LIB is to enable researchers to programmatically define molecular simulations. Traditionally these have been performed using a collection of executables and a manual workflow followed by a “black-box” simulation engine. NB-LIB allows users to script a variety of novel simulation and analysis workflows at a more granular level.

This package contains the shared library, libnblib-gmx.

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Architecture Version Package Size Installed Size Files
sparc64 (unofficial port) 2024.1-1+b1 278.7 kB2,119.0 kB [list of files]