ATOMS: Applied Thermodynamics and Molecular Simulation's repositories
postlammps
A tool for performing post-processing of lammps log files
atoms_site
ATOMS Web Site
USER-ATOMS
A LAMMPS user package developed at ATOMS/UFRJ
atomsmm_examples
Example Scripts using AtomsMM
PSCP-article-2023
Additional information about the article "Revisiting the Pseudo-supercritical path Method: An Improved Formulation for the Alchemical Calculation of Solid-Liquid Coexistence"
jctc-lbf-paper
Additional information about the manuscript "A New Formulation for the Concerted Alchemical Calculation of van der Waals and Coulomb Components of Solvation Free Energies".
atomsmm-lib
Shared Libraries for AtomsMM
usefulscripts
Some useful shell scripts for academic writing and programming
USER-ALCHEMICAL
A LAMMPS user package for alchemical free-energy calculations