Alternatives and similar repositories for lammps_interface

Users that are interested in lammps_interface are comparing it to the libraries listed below

• hernanchavezthielemann / GRO2LAM
  Gromacs to Lammps simulation converter
  ☆86Updated 2 years ago
• paduagroup / fftool
  Tool to build force field input files for molecular simulation
  ☆185Updated last week
• MaginnGroup / PyLAT
  ☆111Updated 3 years ago
• robinzyb / cp2kdata
  cp2k postprocessing tools
  ☆74Updated last week
• iRASPA / RASPA2
  Classical molecular simulation code
  ☆145Updated last year
• paduagroup / clandp
  Force field for ionic liquids
  ☆70Updated last week
• SINGROUP / pycp2k
  Python Cp2k interface
  ☆100Updated 3 years ago
• orlandoacevedo / IL
  Ionic liquid force field parameters (OPLS-2009IL and OPLS-VSIL)
  ☆72Updated last year
• materialyzeai / pymatgen-analysis-diffusion
  This add-on to pymatgen provides tools for analyzing diffusion in materials.
  ☆132Updated last week
• SarkisovGitHub / PoreBlazer
  PoreBlazer (v4.0) source code, examples, and geometric properties of porous materials calculated for the subset of 12,000 structures from…
  ☆54Updated 2 years ago
• BingqingCheng / ASAP
  ASAP is a package that can quickly analyze and visualize datasets of crystal or molecular structures.
  ☆152Updated last year
• freitas-rodrigo / FreeEnergyLAMMPS
  Examples demonstrating how to reproduce the results in the paper.
  ☆68Updated last year
• VASPsol / VASPsol
  ☆73Updated 8 months ago
• EfremBraun / calc-ir-spectra-from-lammps
  This code shows how to calculate an IR spectrum from a LAMMPS MD simulation.
  ☆53Updated 7 years ago
• dadaoqiuzhi / RMD_Digging
  RMD_digging is aimed to provide pre-processing and post-processing tools for the reactive molecular dynamics (ReaxFF) simulations based o…
  ☆49Updated 6 months ago
• zhenxingwang / lammps-conp
  Constant potential method in LAMMPS
  ☆52Updated 2 years ago
• akohlmey / topotools
  VMD plugin for manipulating topology information
  ☆41Updated 6 months ago
• giorginolab / vmd_density_profile
  Computing 1-D atomic densities in macromolecular simulations: The density profile tool for VMD.
  ☆37Updated 2 years ago
• deepmodeling / reacnetgenerator
  an automatic reaction network generator for reactive molecular dynamics simulation
  ☆95Updated last week
• compchem-cybertraining / Tutorials_CP2K
  Tutorials on CP2K calculations
  ☆60Updated 4 years ago
• avishart / CP2K_Editor
  CP2K Editor is a simple GUI for creating input files in the atomistic program CP2K. It is a easy and fast way to create the complex input…
  ☆57Updated 6 years ago
• brucefan1983 / GPUMD-Tutorials
  Tutorials related to GPUMD
  ☆73Updated last week
• tobacco-mofs / tobacco_3.0
  ☆66Updated 4 years ago
• by-student-2017 / lammps_education_reaxff_win
  ☆39Updated 2 months ago
• tamaswells / XDATCAR_toolkit
  XDATCAR_toolkit- A tool for convert XDATCAR to PDB
  ☆62Updated 6 years ago
• MaterSim / PyXtal_FF
  Machine Learning Interatomic Potential Predictions
  ☆94Updated last year
• henniggroup / VASPsol
  Solvation model for the plane wave DFT code VASP.
  ☆171Updated 2 months ago
• nanotheorygroup / kaldo
  Anharmonic Lattice Dynamics
  ☆165Updated last week
• materialyzeai / mlearn
  Benchmark Suite for Machine Learning Interatomic Potentials for Materials
  ☆108Updated 3 years ago
• numat / RASPA2
  NO LONGER UPDATED. Use the official repository.
  ☆85Updated 5 years ago