for Quantum Crystallography
☆28Apr 27, 2026Updated last week
Alternatives and similar repositories for tonto
Users that are interested in tonto are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- Spherical harmonic shape descriptors, promolecule densities, isosurfaces and Hirshfeld surfaces in python☆28Mar 9, 2026Updated last month
- Software to calculate atomic scattering factors and properties for Quantum Crystallography☆13Apr 20, 2026Updated 2 weeks ago
- ☆21Apr 30, 2026Updated last week
- Quantum Chemistry Laboratory package☆20Jun 22, 2022Updated 3 years ago
- QUICK, a GPU-enabled ab intio quantum chemistry software. Now move to the main branch: https://github.com/merzlab/QUICK☆11Jan 19, 2015Updated 11 years ago
- Managed Kubernetes at scale on DigitalOcean • AdDigitalOcean Kubernetes includes the control plane, bandwidth allowance, container registry, automatic updates, and more for free.
- An optimized libcint branch for X86 architecture☆31Nov 17, 2025Updated 5 months ago
- Open Computational Chemistry in C++☆28Apr 30, 2026Updated last week
- Conformer-Rotamer Ensemble Sampling Tool based on the xtb Semiempirical Extended Tight-Binding Program Package☆35Nov 24, 2025Updated 5 months ago
- DensToolKit is a suite of programs for analyzing the molecular electron density (ρ) and several fields derived from it. DTK also include…☆22Sep 24, 2025Updated 7 months ago
- A simple X11 molecular viewer☆24Mar 22, 2026Updated last month
- An efficient toolkit for chemical resonance analysis based on quantum chemistry calculations. It implements the quantitative theory of re…☆28Apr 13, 2023Updated 3 years ago
- An interface program between Gaussian and CFour.☆13Sep 18, 2023Updated 2 years ago
- The core of the SEAMM environment and graphical interface.☆17Mar 19, 2026Updated last month
- A Toolbox for Post-Processing Quantum Chemical Wavefunction Data☆101Jul 24, 2021Updated 4 years ago
- Proton VPN Special Offer - Get 70% off • AdSpecial partner offer. Trusted by over 100 million users worldwide. Tested, Approved and Recommended by Experts.
- Molden2AIM is a utility program which can be used to create AIM-WFN, AIM-WFX, and NBO-47 files from a Molden file.☆59Jul 17, 2025Updated 9 months ago
- WEAS is JavaScript library to visualize and manipulate the atomic structures directly in the web browser.☆14Apr 21, 2026Updated 2 weeks ago
- A very simple quantum chemistry program☆10Jan 4, 2019Updated 7 years ago
- Main repository for the CP-PAW code☆12Apr 29, 2026Updated last week
- Software for analysis of time-resolved and transient absorption data from pump-probe experiments (1D) and 2D-IR☆16Updated this week
- blend molecules!☆43Oct 13, 2025Updated 6 months ago
- Fast computation of a gaussian and its derivative on a grid.☆31Sep 26, 2025Updated 7 months ago
- Open Source Exascale Quantum Chemistry Software☆32Apr 12, 2026Updated 3 weeks ago
- ☆13Jul 20, 2022Updated 3 years ago
- GPU virtual machines on DigitalOcean Gradient AI • AdGet to production fast with high-performance AMD and NVIDIA GPUs you can spin up in seconds. The definition of operational simplicity.
- SpecDis is a handy tool to process the results of quantum-chemical ECD/UV, ORD, or VCD/IR calculations. It supports diverse software pack…☆11Oct 13, 2017Updated 8 years ago
- Program for Molecular Fock Dirac calculations☆12Apr 16, 2020Updated 6 years ago
- a unified interface for molecular harmonic vibrational frequency calculations☆33Jul 28, 2025Updated 9 months ago
- Analysis of quantum chemical interactions in molecules and solids.☆119Apr 19, 2026Updated 2 weeks ago
- Visualization and editing of periodic molecular structure files.☆28Jan 20, 2026Updated 3 months ago
- A package for plotting and manipulating 1D spectra☆12Jul 30, 2024Updated last year
- Python tool to manipulate Gaussian cube files☆49Jul 6, 2023Updated 2 years ago
- Quantum Chemistry Teaching Labs and Exercises☆11Aug 16, 2022Updated 3 years ago
- OpenRSP: open-ended response theory.☆16Aug 16, 2020Updated 5 years ago
- Deploy open-source AI quickly and easily - Special Bonus Offer • AdRunpod Hub is built for open source. One-click deployment and autoscaling endpoints without provisioning your own infrastructure.
- Databases and Interoperability in Quantum Chemistry☆13Feb 15, 2018Updated 8 years ago
- CCT3: A PSI4 plugin which performs active-space coupled-cluster CCSDt calculations and which can determine non-iterative corrections to C…☆13Oct 25, 2023Updated 2 years ago
- 2017-09-26 Linux source copied from Sourceforge. This is **not** the development repository.☆24Dec 28, 2021Updated 4 years ago
- C++ library for tensor computations☆37Apr 27, 2023Updated 3 years ago
- sign tieba in command line☆11Dec 6, 2022Updated 3 years ago
- An open-source library for reduced-density matrix-based analysis and computation☆20Apr 2, 2023Updated 3 years ago
- ☆15Jan 1, 2020Updated 6 years ago