| Dezvoltator: | J. Heyrovsky Institute Prague (38) | ||
| Preț: | Gratuit | ||
| Clasificări: | 0 | ||
| Recenzii: | 0 Scrie o recenzie | ||
| Comentarii: | 0 Postează comentariu | ||
| Liste: | 0 + 0 | ||
| Punctele: | 0 + 0 ¡ | ||
| Google Play | |||
Descriere
QuantumChemDroid is a mobile app capable of performing the semiempirical calculations (due to contained ULYSSES code) as well as the single point ab-initio computations (powered by OCC code). All the contained binaries are optimized for maximum performance in the mobile devices. OCC is parallelized, the users can choose number of OpenMP or std. threads for running the job. The app is working completely offline, does not collect, transmit, or distribute any personally identifiable information of the app users.
IMPORTANT !!!
Although this app is composed of open-source codes and resources, licenses for some components require the users to cite the original references when publishing the results. Please check all the licensing information under the buttons 'License' and 'About the app'.
All the users of the QuantumChemDroid app comply by downloading, installing and using it with all the licensing conditions of the individual software components and take the responsibility for keeping them.
App source code: https://github.com/alanliska/QuantumChemDroid
Contact:
Compilation of the source code for Android as well as the Android app development was done by Alan Liška (alan.liska@jh-inst.cas.cz) and Veronika Růžičková (sucha.ver@gmail.com), J. Heyrovský Institute of Physical Chemistry of the CAS, v.v.i., Dolejškova 3/2155, 182 23 Praha 8, Czech Republic.
Website: http://www.jh-inst.cas.cz/~liska/MobileChemistry.htm
List of used third-party software:
ACPDFVIEW, ANDROID SHELL, CATCH2, CLI11, CXXOPTS, EIGEN3, FMT, GAU2GRID, GEMMI, GRAPHVIEW, JSON, LBFGS++, LIBCINT, LIBECPINT, LIBXC, NANOFLANN, OCC, OPENBABEL, OPSIN, PHMAP, POCKETFFT, RAPIDJSON, SCNLIB, SPDLOG, SUBPROCESS, TINYPLY, ULYSSES, X11-BASIC, XSUM.
Info on licenses: please see the full-text licenses under the button Licenses.
ACKNOWLEDGEMENTS:
The authors appreciate the financial support from the GACR projects 18-12150S, 19-22806S, 21-23261S, 23-06465S, and internal (institutional) support RVO: 61388955.
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- Versiune: 0.9
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Android Aplicații›Instrumente - SO:
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https://www.jh-inst.cas.cz/~liska/MobileChemistry.htm «QuantumChemDroid». Platforma: Android. Categorie: Instrumente. Dezvoltator: «J. Heyrovsky Institute Prague». Prima lansare: . Ultima actualizare: . Prețul actual: gratuit. Acest titlu nu a primit încă evaluări sau recenzii pe AppAgg. AppAgg urmărește istoricul prețurilor, evaluările și feedbackul utilizatorilor pentru «QuantumChemDroid». Urmăriți reducerile și actualizările viitoare prin RSS. AppAgg nu găzduiește aplicații și nu distribuie software. Toate mărcile comerciale, siglele și capturile de ecran aparțin proprietarilor respectivi.
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