Global InformationChematica information
| Developer(s) | Elizabeth Wylie, Matthew Wampler-Doty, Ling Su, Andrea Cadeddu, Aaron Oppenheimer, Patrick Fuller, Malous Kossarian, Chris Gothard, Nosheen Gothard, Kamel Meguellati, Mikolaj Kowalik, Kyle Bishop, Bartosz Grzybowski |
|---|---|
| Initial release | N/A |
| Written in | Python, Java, C++, CoffeeScript |
| Platform | Cross-platform |
| Available in | English |
| Type | Computer algebra, numerical computations, Information visualization, statistics, user interface creation |
| License | Proprietary |
Chematica is a software that uses algorithms and a collective database to predict synthesis pathways for molecules. The software development, led by Bartosz A. Grzybowski, was publicized in August 2012. In 2017, the software and database were wholly purchased by Merck KGaA | MRK.[1][2] Since the acquisition, the software has been made commercially available as Synthia.[3]
- ^ Merck KGaA to buy Chematica, by Andy Extance, at ChemistryWorld; published May 12, 2017; retrieved January 1, 2019
- ^ Klucznik, Tomasz; Mikulak-Klucznik, Barbara; McCormack, Michael P.; Lima, Heather; Szymkuć, Sara; Bhowmick, Manishabrata; Molga, Karol; Zhou, Yubai; Rickershauser, Lindsey; Gajewska, Ewa P.; Toutchkine, Alexei (March 2018). "Efficient Syntheses of Diverse, Medicinally Relevant Targets Planned by Computer and Executed in the Laboratory". Chem. 4 (3): 522–532. doi:10.1016/j.chempr.2018.02.002. ISSN 2451-9294.
- ^ Synthia