MolSSI-Education / python_scripting_cms

Python Data and Scripting course for computational chemists
https://molssi-education.github.io/python_scripting_cms
Other
83 stars 33 forks source link

Multiple files #30

Closed janash closed 5 years ago

janash commented 5 years ago

Edits to multiple files lesson.

Made the file paths consistent to the structure of the data directory they download. Also changed the way we are showing them to grab the molecule name from the file. I recommend using os.path.basename as it is more general than grabbing a certain number of characters from a string.