An Avogadro plugin with a gui to create packmol input files and run packmol from within Avogadro.
☆11Mar 3, 2010Updated 16 years ago
Alternatives and similar repositories for Avogadro-Packmol-Extension
Users that are interested in Avogadro-Packmol-Extension are comparing it to the libraries listed below
Sorting:
- Open-source implementation of PC-SAFT equation of state☆12Oct 20, 2022Updated 3 years ago
- Code and examples to compute IR spectra from normal mode analysis☆15Jul 28, 2022Updated 3 years ago
- Playmol is a(nother) software for building molecular models☆19Mar 14, 2023Updated 2 years ago
- DWSIM Thermodynamics Library (legacy version - 3.x)☆22Feb 19, 2023Updated 3 years ago
- Python wrapper for packmol molecule packing program☆12Jan 4, 2016Updated 10 years ago
- ☆18Nov 10, 2021Updated 4 years ago
- A series of ipython notebooks with thermodynamic models for multiphase and multicomponent systems.☆19Jul 20, 2017Updated 8 years ago
- Python module for predicting density, heat capacities and speed of sound of pure fluids using Peng-Robinson, (Soave-)Redlich-Kwong and Le…☆21Oct 19, 2022Updated 3 years ago
- Tools for ThermoML parsing☆21Sep 20, 2021Updated 4 years ago
- Functions implementing the PC-SAFT equation of state, including association, electrolyte and dipole terms☆55Sep 3, 2024Updated last year
- Chemical equilibrium for electrolytes system in pure python.☆27Mar 29, 2022Updated 3 years ago
- a tool for creating Molecular Dynamics-ready models of polymeric systems☆23Feb 25, 2019Updated 7 years ago
- Python implementation of the DHLLDV slurry transport framework☆10Nov 9, 2025Updated 3 months ago
- Cross-platform engineering nonlinear equations systems solver [Under construction 🚧]☆32Jul 10, 2024Updated last year
- CP2K binaries for 32/64 bit Windows☆30Jan 12, 2026Updated last month
- BioSTEAM's Premier Thermodynamic Engine☆74Feb 9, 2026Updated 3 weeks ago
- Resources for and by the #codingForChemists Discord community!☆10Jun 18, 2023Updated 2 years ago
- we collected Gram-stained bacteria images from lower respiratory tract specimens of patients with lung infections in Chinese PLA General…☆12Jan 18, 2024Updated 2 years ago
- Automatic differentiation based compositional reservoir simulation module☆11Oct 11, 2018Updated 7 years ago
- MDAnalysis wrapper around Packmol☆37May 1, 2023Updated 2 years ago
- PDBClean helps create a curated ensemble of molecular structures☆16Feb 20, 2026Updated 2 weeks ago
- VMD Plugin and associated scripts to build lignin structures from topological specifications☆17Jul 17, 2025Updated 7 months ago
- Online decision support tool to create local energy situations for neighbourhoods, cities and regions with a time resolution of 15 minute…