Axel Kohlmeyer

LAMMPS-GUI - The graphical interface for learning and running LAMMPS

Axel Kohlmeyer's development repository of the LAMMPS MD software package

MBX is an energy and force calculator for data-driven many-body simulations.

VMD plugin for manipulating topology information

Lennard-Jones MD code in Fortran for teaching purposes

A library of optimized math functions targeted at 32-bit and 64-bit x86 Linux systems

Lennard-Jones MD code in C for teaching purposes

Simple makefile-based build for musl cross compiler

TclMPI - MPI Bindings for Tcl

Inputs and solutions for LAMMPS tutorial paper

A library that enables code interoperability via the MolSSI Driver Interface.

No description provided.

OpenMM is a toolkit for molecular simulation using high performance GPU code.

No description provided.

A sphinx-doc extension that allows you to write LaTeX algorithm directly inside sphinx-doc

The Microsoft community Windows Package Manager manifest repository

GoogleTest - Google Testing and Mocking Framework

n2p2 - A Neural Network Potential Package

Fortran domain and autodoc extensions to Sphinx

Canonical source repository for LibYAML

A modern formatting library

ScaFaCoS library for Fast Coulomb Solvers

Kokkos C++ Performance Portability Programming EcoSystem: The Programming Model - Parallel Execution and Memory Abstraction

LJMD Refactoring for MHPC

VMD plugins for computing spectral densities

Roku Remote Control App in Tk/Tcl

The VMD PBC tools are Tcl scripts to be used with the VMD software, that allow to handle periodic boundary conditions.

The VTF Plugin is a plugin for the VMD software that reads the VTF format.