Skip to content

Simple tools to manipulate / convert / analyze xyz trajectory files under NPBC

Notifications You must be signed in to change notification settings

tuthmose/xyztools

Folders and files

NameName
Last commit message
Last commit date

Latest commit

 

History

1 Commit
 
 
 
 
 
 
 
 

Repository files navigation

xyztools

Simple tools to extract coordinates from a Gaussian checkpoint file (not standard version) or convert a xyz trajectory file (e. g. from CPMD) to xtc. Just a wrapper around xdrlib

About

Simple tools to manipulate / convert / analyze xyz trajectory files under NPBC

Resources

Stars

Watchers

Forks

Releases

No releases published

Packages

No packages published