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The topology graphs will not use the default implementation of construct() but instead have an implementation that just
calls autografs internally
This idea can be re-used for all sorts of other molecular - construction packages providing easy integration and structures for our users
The text was updated successfully, but these errors were encountered:
lukasturcani
changed the title
Make a new set of topology graphs which use https://github.com/DCoupry/autografs
Make a new set of topology graphs which use other construction libraries
Mar 8, 2023
Probably make a new repository / python package
stk-autgrafs
or add an optional dependencyhttps://github.com/DCoupry/autografs
The topology graphs will not use the default implementation of
construct()
but instead have an implementation that justcalls autografs internally
This idea can be re-used for all sorts of other molecular - construction packages providing easy integration and structures for our users
The text was updated successfully, but these errors were encountered: