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...Interfaces are available for xTB, DFTB+, Gaussian, Turbomole, CRYSTAL, and ASE-based workflows. External programs must be installed separately. Installation: open the Code tab and download or clone the complete repository. On Linux, open a terminal in `qmcf2_installer` and run: `python3 qmcf2_installer.py3` Review the detected compilers, libraries, paths, and warnings, then start the build. The manual is located at `qmcf2_html/qmcf2_doc/manual/qmcf2_manual.pdf`. QMCF2 is research software under active development. ...

This tool is an integrated graphical interface that simplifies molecular dynamics simulations using Gromacs. It provides a structured, tab-based environment to set up, execute, and analyze simulations data without complex command-line operations. The software automates tasks such as topology generation, solvation, ion addition, minimization, equilibration, and production runs while executing GROMACS commands in the background. Built-in monitoring tracks CPU, RAM, and disk usage to ensure stable performance during parallel processing. ...

...All the parameters : name, mmsi, initial position (lat/long), COG, SOG for my boat as well as for AIS targets, and I/O configuration (com port...) can be edited in the 'datasimul.json' (file created by the app with default values in V1.0) Just Download the nmeasim.exe file (green button above) and launch it. Be patient for a few seconds if you have a slow PC! Go to the 'Files' tab to look at the readme file and download any additional file if needed.