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评价

4.48/5
(40 评价)

QR码

价格
免费

版本
1.2.6

下载
5 000 - 10 000
Estimate :
5,405

大小
257.1 KB

类别

Atomdroid

Available in :
The Atomdroid app is a computational chemistry tool for the Android platform. It can be used as a molecular viewer/builder and contains local optimization and Monte Carlo simulation features. Install now and experience mobile computational chemistry!

List of features:

* molecular viewing (compatible with xyz and pdb files)
* molecular building (export to xyz)
* PDB downloader (requires the Internet permission, downloads compressed pdb to save on your data plan)
* local optimization (L-BFGS and Powell algorithms)
* Monte Carlo simulation and analysis
* Global optimization using a Monte Carlo with minimizations approach
* Universal Force Field (UFF) implementation (currently without electrostatics)

Future versions will contain:

* more force field implementations (including analytical gradients)
* molecular dynamics engine
* and more...

The application is currently in beta state. Please report any bugs to compchem.goettingen@gmail.com, we will be pleased to solve them quickly.


iPhone相關的為Atomdroid

Atomdroid was developed for Android by CCB Goettingen

包名称 : org.atomdroid

系统权限 : 2 点击这里以显示或隐藏列表
  • android.permission.WRITE_EXTERNAL_STORAGE
  • android.permission.INTERNET

I am the developer of this Application !
|||||Email



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