QuantumATK (formerly Atomistix ToolKit or ATK) is a commercial software for atomic-scale modeling and simulation of nanosystems. The software was originally...
4 KB (332 words) - 08:15, 28 August 2024
all assets from the Atomistix estate and would continue the development and marketing of the products Atomistix ToolKit and Atomistix Virtual NanoLab. QuantumWise...
6 KB (550 words) - 20:18, 12 September 2024
transport calculations. Atomistix ToolKit is developed from the academic codes TranSIESTA and McDCal. Atomistix ToolKit NanoLanguage Atomistix QuantumWise acquired...
3 KB (312 words) - 05:41, 19 October 2023
MEDIT, Chemical Computing Group, MolSoft LLC, and the Chemistry Development Kit. A common application of canonical SMILES is indexing and ensuring uniqueness...
32 KB (3,645 words) - 09:30, 13 January 2025
RDKit is open-source toolkit for cheminformatics. It was developed by Greg Landrum with numerous additional contributions from the RDKit open source community...
2 KB (71 words) - 13:59, 20 March 2024
Samer; Krylov, Anna I. (2021-05-31). "The ezSpectra suite: An easy‐to‐use toolkit for spectroscopy modeling". WIREs Computational Molecular Science. 12 (2)...
27 KB (512 words) - 19:56, 25 March 2025
Windows, Linux ASCEND Carnegie Mellon University Windows, macOS, Linux Atomistix ToolKit Synopsys Windows, macOS, Linux AutoCAD Autodesk Windows, macOS AutoCAST...
8 KB (159 words) - 17:56, 15 May 2025
code-specific keywords. NanoLanguage was introduced by Atomistix A/S as an interface to Atomistix ToolKit (version 2.1) in order to provide a more flexible...
4 KB (436 words) - 02:40, 13 April 2025
part of the Andrew Project used to create and distribute documents Atomistix ToolKit, software for atomic-scale modeling ATK (football club), Indian football...
1 KB (187 words) - 07:37, 16 July 2023
Jmol Molekel PyMOL QuteMol RasMol Proprietary Abalone ACD/ChemSketch Atomistix ToolKit ChemDraw ChemWindow EzMol Gaussian Maestro MarvinSketch MarvinView...
2 KB (167 words) - 08:31, 12 August 2023
io - a powerful platform for nanoscale modelling Ascalaph Designer Atomistix ToolKit and Virtual NanoLab CoNTub CP2K CST Studio Suite Deneb – graphical...
7 KB (621 words) - 03:29, 3 March 2025
No Yes Yes Yes Yes Yes Yes Yes Yes No Yes Yes Libxc Abinit ADF APE Atomistix ToolKit AtomPAW BigDFT Castep CP2K DP Elk ERKALE exciting GPAW JDFTx MOLGW...
26 KB (2,504 words) - 16:04, 26 June 2024