+
Skip to content

jmwoll/isocalc

Folders and files

NameName
Last commit message
Last commit date

Latest commit

 

History

7 Commits
 
 
 
 
 
 
 
 
 
 
 
 

Repository files navigation

With isocalc, isotopic patterns can be calculated from python. It is not accurate (e.g. not considering electrons), and very inefficient, but still sometimes useful for quickly screening isotopic patterns and for teaching. For example, the code

from isocalc import isocalc
isocalc.plot_isotope_distribution("C1")

will result in the following plot:

Example Isotopic Pattern.

While the following code:

from isocalc import isocalc
isocalc.plot_isotope_distribution("C1Br4")

will result in the following plot with several isotopic peaks:

Example Isotopic Pattern.

About

Python isotopic pattern calculator library

Topics

Resources

License

Stars

Watchers

Forks

Releases

No releases published

Packages

No packages published

Languages

点击 这是indexloc提供的php浏览器服务,不要输入任何密码和下载