Alternatives and similar repositories for packmol

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

• paduagroup / fftool
  Tool to build force field input files for molecular simulation
  ☆170Updated 4 months ago
• shirtsgroup / InterMol
  Conversion tool for molecular simulations
  ☆203Updated last year
• crest-lab / crest
  CREST - A program for the automated exploration of low-energy molecular chemical space.
  ☆258Updated 3 weeks ago
• i-pi / i-pi
  i-PI: a universal force engine
  ☆263Updated last week
• Colvars / colvars
  Collective variables library for molecular simulation and analysis programs
  ☆227Updated this week
• CompPhysVienna / n2p2
  n2p2 - A Neural Network Potential Package
  ☆235Updated 3 months ago
• jewettaij / moltemplate
  A general cross-platform tool for preparing simulations of molecules and complex molecular assemblies
  ☆290Updated 3 months ago
• deepmodeling / dpdata
  A Python package for manipulating atomistic data of software in computational science
  ☆212Updated this week
• marrink-lab / polyply_1.0
  Generate input parameters and coordinates for atomistic and coarse-grained simulations of polymers, ssDNA, and carbohydrates
  ☆155Updated last month
• brucefan1983 / Molecular-Dynamics-Simulation
  Sample codes for my book on molecular dynamics simulation
  ☆238Updated 4 months ago
• lammpstutorials / lammpstutorials.github.io
  LAMMPS tutorials for both beginners and advanced users
  ☆115Updated this week
• dftd4 / dftd4
  Generally Applicable Atomic-Charge Dependent London Dispersion Correction
  ☆187Updated 3 weeks ago
• SINGROUP / pycp2k
  Python Cp2k interface
  ☆95Updated 3 years ago
• MaginnGroup / PyLAT
  ☆108Updated 2 years ago
• BingqingCheng / ASAP
  ASAP is a package that can quickly analyze and visualize datasets of crystal or molecular structures.
  ☆148Updated 11 months ago
• openmopac / mopac
  Molecular Orbital PACkage
  ☆147Updated last month
• peteboyd / lammps_interface
  automatic generation of LAMMPS input files for molecular dynamics simulations of MOFs
  ☆153Updated 2 years ago
• MolSSI-BSE / basis_set_exchange
  A repository for quantum chemistry basis sets
  ☆173Updated 4 months ago
• ipudu / awesome-molecular-dynamics
  A curated list of awesome Molecular Dynamics libraries, tools and software.
  ☆115Updated 3 years ago
• leeping / geomeTRIC
  Geometry optimization code that includes the TRIC coordinate system
  ☆180Updated 4 months ago
• hernanchavezthielemann / GRO2LAM
  Gromacs to Lammps simulation converter
  ☆80Updated last year
• scanberg / viamd
  Visual Interactive Analysis of Molecular Dynamics
  ☆297Updated 2 weeks ago
• grimme-lab / xtb
  Semiempirical Extended Tight-Binding Program Package
  ☆667Updated 2 weeks ago
• SSAGESproject / SSAGES
  Software Suite for Advanced General Ensemble Simulations
  ☆87Updated 2 years ago
• openforcefield / openff-toolkit
  The Open Forcefield Toolkit provides implementations of the SMIRNOFF format, parameterization engine, and other tools. Documentation avai…
  ☆344Updated this week
• infretis / infretis
  A python library for replica exchange transition interface sampling with infinite swaps
  ☆9Updated 2 weeks ago
• libAtoms / QUIP
  libAtoms/QUIP molecular dynamics framework: https://libatoms.github.io
  ☆364Updated last month
• FitSNAP / FitSNAP
  Software for generating machine-learning interatomic potentials for LAMMPS
  ☆167Updated 3 weeks ago
• TinkerTools / tinker
  Tinker: Software Tools for Molecular Design
  ☆142Updated last month
• patonlab / GoodVibes
  Calculate quasi-harmonic free energies from Gaussian output files with temperature and other corrections
  ☆146Updated 9 months ago