SwingJS-compatible Jmol/JSmol for Java and JavaScript molecular visualization and analysis
☆59Feb 28, 2026Updated last week
Alternatives and similar repositories for Jmol-SwingJS
Users that are interested in Jmol-SwingJS are comparing it to the libraries listed below
Sorting:
- A tool for generating unique ordered structures corresponding to a given disordered structure.☆17Dec 28, 2023Updated 2 years ago
- Macromolecular viewer for crystallographers (WebGL)☆40Aug 8, 2025Updated 7 months ago
- A fortran package and library for continuum embedding calculations in materials and molecules☆20Jan 16, 2026Updated last month
- JupyterLab extension for py3Dmol☆22Jan 2, 2022Updated 4 years ago
- ☆12Apr 16, 2018Updated 7 years ago
- An Extended Periodic Table of Neutral and Charged Atomic Species☆42Oct 16, 2025Updated 4 months ago
- Calculate the dispersion energy and related quantities in gas-phase systems using the exchange-hole dipole moment (XDM) model.☆23May 29, 2025Updated 9 months ago
- Multi-collinear functional☆10Feb 12, 2026Updated 3 weeks ago
- ☆11Feb 20, 2026Updated 2 weeks ago
- pymatgen-analysis-alloys is an add-on package for pymatgen intended to contain useful classes for describing alloy systems and analyzing …☆16Oct 31, 2025Updated 4 months ago
- Automated DFT Input File Generator using wxDragon☆15Sep 21, 2023Updated 2 years ago
- A visualization program for the display, manipulation, and analysis of isolated molecules and periodic structures☆46Jun 26, 2025Updated 8 months ago
- AiiDA plugin of the high-performance density functional theory code FLEUR (www.judft.de) for high-throughput electronic structure calcula…☆15Dec 1, 2025Updated 3 months ago
- GMTKN test sets in python☆11Dec 17, 2021Updated 4 years ago
- bands4vasp -- post processing package for the analysis of unfolded eigenstates in VASP, and much more: band structures, 2D and 3D Fermi s…☆14Jul 30, 2025Updated 7 months ago
- A library for symmetry operations and linear interpolation within an irreducible part of the first Brillouin zone.☆17Nov 11, 2025Updated 3 months ago
- Plane-Wave density-functional theory (DFT) development for NWChemEx electronic structure software☆14Feb 24, 2026Updated last week
- A web app to convert a PyMOL PSE file or PDB file to a easy to implement NGL.js view that can be implemented easily on any site☆12Nov 12, 2021Updated 4 years ago
- Statistical models to predict new materials☆14May 9, 2023Updated 2 years ago
- FLOSIC code is used for performing self-interaction corrected (SIC) density functional approximation calculations. Fermi Löwdin orbital i…☆17Sep 11, 2025Updated 5 months ago
- A standalone library of the GFN-FF method. Extracted in large parts from the xtb program.☆16Jan 27, 2025Updated last year
- Python input file generators for Avogadro 2☆16Feb 27, 2026Updated last week
- Collective atomic modulation analysis with irreducible space-group representation☆18Mar 2, 2026Updated last week
- A modern DFT + DMFT computation framework☆16Oct 2, 2025Updated 5 months ago
- Visualizations☆14Jan 10, 2022Updated 4 years ago
- Python package for detecting spin space group on top of spglib☆20Oct 29, 2025Updated 4 months ago
- Interface to DFT codes. Supported by the Flatiron Institute.☆42Updated this week
- A modern C++ library for high-performance configuration interaction methods☆20Feb 3, 2026Updated last month
- Tools for performing vibrational analysis on molecular systems.☆18Sep 15, 2023Updated 2 years ago
- Set of IJulia notebooks modeling different aspects of the world☆15Dec 13, 2018Updated 7 years ago
- Graphic user interface (GUI) for the battery database.☆16Feb 10, 2023Updated 3 years ago
- The Open Spectral Database - Its all about the data☆18Aug 7, 2024Updated last year
- software package for tight-binding DFT calculations on ground and excited states of molecules☆13Feb 13, 2020Updated 6 years ago
- 2017-09-26 Linux source copied from Sourceforge. This is **not** the development repository.☆21Dec 28, 2021Updated 4 years ago
- Python tools for quantum chemical calculations☆21Jan 19, 2024Updated 2 years ago
- quick analysis of vasp calculation☆38Jun 7, 2024Updated last year
- The Massively Parallel Quantum Chemistry program, MPQC, computes properties of atoms and molecules from first principles using the time i…☆80Aug 8, 2023Updated 2 years ago
- A set of tools used for setup, analysis and post-processing of Density Functional Theory (DFT) calculations performed with the VASP packa…☆17Feb 5, 2018Updated 8 years ago
- Open Computational Chemistry in C++☆24Feb 11, 2026Updated 3 weeks ago