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Atomdroid

Atomdroid

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Atomdroid 截图

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Atomdroid 描述

### NEW ###
Initial ribbons support (no sheets yet)
Check the server news for HOWTOs and explanations.
Contribute your molecules to the library (share button) and enter our contributor ranking!
Please report any problems via mail! :-)
### NEXT ###
Complete ribbons support
###
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)
* trajectory analysis and viewing
* molecular building (export to xyz)
* PDB downloader (requires the Internet permission, downloads compressed pdb to save on your data plan)
* Atomdroid molecular libraries (requires the Internet permission)
* 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)
* communication with other Atomdroid users via bluetooth and share your molecules (requires bluetooth permission, we are VERY cautious with using it)
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.
Support for Atomdroid molecular libraries: If you want to create your own library (e.g. for courses) let us know via mail and we provide you with the necessary tools and information free of charge!
###新###
初步支持带(无张尚)
检查HOWTO文档和说明服务器的消息。
贡献您的分子图书馆(共享按钮),进入我们的贡献者的排名!
请通过电子邮件报告任何问题! :-)
### 下一个 ###
完全支持丝带
###
该Atomdroid应用程序是为Android平台的计算化学的工具。它可以被用来作为一种分子观众/建设者,并包含局部优化和蒙特卡罗模拟功能。现在安装和体验移动计算化学!
的功能列表:
*分子观看(和XYZ和PDB文件兼容)
*轨迹分析和查看
*分子大楼(出口XYZ)
* PDB下载(需要Internet权限,压缩下载PDB,以节省您的资料图)
* Atomdroid分子库(需要Internet权限)
*局部优化(L-BFGS和鲍威尔算法)
*蒙特卡罗模拟和分析
*使用蒙特卡罗与minimizations方法全局优化
*通用力场(UFF)实施(目前无静电)
*通过蓝牙和分享您的分子其他Atomdroid用户通信(需要蓝牙权限,我们用它非常谨慎)
未来的版本将包括:
*更力场实现(包括分析梯度)
*分子动力学引擎
* 和更多...
该应用程序目前处于测试状态。请报告任何错误,以compchem.goettingen@gmail.com,我们将高兴地迅速解决这些问题。
对于Atomdroid分子库支持:如果你想创建自己的库(例如,用于课程),让我们通过邮件知道,我们为您提供免费的必要的工具和信息!

Atomdroid 更新内容

* initial support for ribbons (no sheets yet!)
* higher thresholds for computing tasks allowing for bigger systems
* recently added molecules tab for server
* smaller fixes

Atomdroid 历史版本

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Atomdroid 应用内最新内容

Atomdroid 信息

大小
345.11K
分类
教育培训 其它
TAG
更新
版本
1.5.0
要求
Android 2.2.x 以上
查看权限要求
来自
Google Play

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