| 開發人員: | J. Heyrovsky Institute Prague (38) | ||
| 價錢: | 免費 | ||
| 排名: | 0 | ||
| 評測: | 0 寫評論 | ||
| 註釋: | 0 發表評論 | ||
| 清單: | 0 + 0 | ||
| 點數: | 0 + 0 ¡ | ||
| Google Play | |||
描述
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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開發人員
- J. Heyrovsky Institute Prague
- 平台: Android 應用程式 (38)
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其他資訊
- 版本: 0.9
- 類別 :
Android 應用程式›工具 - OS:
Android 7.0 - 大小:
24 Mb - 內容分級:
Everyone - Google Play 評分:
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https://www.jh-inst.cas.cz/~liska/MobileChemistry.htm «QuantumChemDroid». 平台： Android. 類別： 工具. 開發商： «J. Heyrovsky Institute Prague». 首次發布： . 最後更新： . 目前價格： 免費. 此項目尚未在 AppAgg 上獲得評分或評論。 AppAgg 會追蹤 «QuantumChemDroid»的價格歷史、評分和用戶回饋。 關注未來折扣和更新： RSS. AppAgg 不託管應用程式或分發軟體。 所有商標、標誌和螢幕截圖均屬於其各自所有者。
QuantumChemDroid 縮短網址: 已複製!- 🌟 分享
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