開發人員:
價錢: 免費
排名: 0 
評測: 0 寫評論
清單: 0 + 0
點數: 0 + 0 ¡
Mac App Store

描述

Orange NMR for Mac OS X
App to predict 13C and 1H NMR spectra: draw a structure to see its spectrum. The accuracy of the algorithm is about 1.9 ppm for 13C and 0.21 ppm for 1H (RMSD=3.4 and 0.31 ppm correspondingly).
The number of heavy atoms in structure to predict for free is restricted to 12 atoms. This restriction can be removed by purchasing additional licenses.

- Draw chemical structure;
- Instantly re-calculate spectrum while changing structure;
- Exchange data with mobile devices via iCloud;
- Print report;
- Zoom in spectrum;
- Option to display chemical shift values on structure;
- Simple clean interface.

The mobile version is available in App Store: http://itunes.apple.com/app/nmr-prediction/id662859811

The prediction algorithm is derived by:
K. A. Blinov, E. D. Smurnyy, T. S. Churanova, M. E. Elyashberg, A. J. Williams, Chemom. Intell. Lab. Syst. 2009, 97, 91
更多 ↓

螢幕擷取畫面

#1. Orange NMR for Mac OS X (macOS) 由: Kirill Blinov
#2. Orange NMR for Mac OS X (macOS) 由: Kirill Blinov
#3. Orange NMR for Mac OS X (macOS) 由: Kirill Blinov
#4. Orange NMR for Mac OS X (macOS) 由: Kirill Blinov

新功能

  • 版本: 2.4
  • 發佈日期:
  • More accurate 3J H-H couplings prediction.

價錢

  • 今天: 免費
  • 最小值: 免費
  • 最大值: 免費
追蹤票價

開發人員

點數

未找到 ☹️

排名

未找到 ☹️

清單

未找到 ☹️

評測

成為第一個評論 🌟

其他資訊

Orange NMR for Mac OS XOrange NMR for Mac OS X 縮短網址: 已複製!

你可能還喜歡

    • DrawMol
    • macOS 應用程式: 教育  由: UNamur
    • $24.99   
    • 清單: 0 + 0   排名: 0   評測: 0
    • 點數: 1 + 0   版本: 2.2.5   DrawMol, a powerful graphical interface to visualize and build molecular structures. CITATION If you use DrawMol for your scientific work, please cite the DrawMol program in your ...
        ⥯ 
    • Visualizing Organic Chemistry
    • macOS 應用程式: 教育  由: Aaron M. Hartel
    • $7.99   
    • 清單: 0 + 0   排名: 0   評測: 0
    • 點數: 0 + 0   版本: 1.3   Visualizing Organic Chemistry is a collection of tools that make learning organic chemistry easier. It s an excellent resource for instructors and students alike! The app contains over
        ⥯ 
    • T1calc
    • macOS 應用程式: 教育  由: JPG Malthouse
    • 免費   
    • 清單: 1 + 0   排名: 0   評測: 0
    • 點數: 2 + 0   版本: 1.0.6   This program calculates the spin lattice relation time (T1) and linewidth of a carbon atom relaxing by interacting with up 5 different nuclei by dipolar relaxation and or by Chemical ...
        ⥯ 
    • Dot to Dot - Ocean
    • macOS 應用程式: 教育  由: Kedronic UAB
    • 免費   
    • 清單: 0 + 0   排名: 0   評測: 0
    • 點數: 0 + 0   版本: 2.0   The underwater world is diverse and beautiful. It hides many things that are waiting to be discovered! It would be quite interesting to be able to explore the waters of the world ocean
        ⥯ 
    • Stoichiometry
    • macOS 應用程式: 教育  由: Roman Volinsky
    • $3.99   
    • 清單: 0 + 0   排名: 0   評測: 0
    • 點數: 0 + 0   版本: 2.4   Stoichiometry for Mac is an ultimate tool for balancing chemical reactions, finding molar masses, moles and actual masses of reactants and products based on their chemical formulas, ...
        ⥯ 
    • Epicycles.
    • macOS 應用程式: 教育  由: Limit Point Software
    • 免費   
    • 清單: 0 + 0   排名: 0   評測: 0
    • 點數: 0 + 0   版本: 1.1.4   The Epicycles app is a tool for exploring the visualization of complex Fourier series. It allows users to interactively create and visualize epicycles based on sampled parametric ...
        ⥯ 

你可能還喜歡

可搭配 AppAgg 使用的搜尋運算子
添加到 AppAgg
AppAgg
立即免费注册
註冊
登入