1.0.1

update of test system parameter files for GROMACS-2022 and notes in documentation

v1.0.0

First full release of the 3D-2PT source code including a test system and examples execution scripts in BASH.

Requirements:

• FFTW library (version 3.0 or higher, www.fftw.org) compiled in single precision

Recommended:

• functioning GNU make for simple compilation
• GROMACS (2018.1 or higher, http://www.gromacs.org/)
• VMD (Visual Molecular Dynamics, version 1.9.3 or higher, http://www.ks.uiuc.edu/Research/vmd)