Name:
[116] Erik Thompson
Member:
60 months
Authored:
44 videos
Description:
Hi! I am currently a full time student at California State University Long Beach. I recently began to do research in molecular dynamics. I have interests in Python programming, physics, chemistry, and 3D simulation.
Also I like bird watching! Here are some of photos I've taken:
http://ww ...
Coding the Molecule, Atom, and Bond Classes [ID:489] (10/35)
in series: Developing emol!
video tutorial by Erik Thompson, added 01/08
Name:
[116] Erik Thompson
Member:
60 months
Authored:
44 videos
Description:
Hi! I am currently a full time student at California State University Long Beach. I recently began to do research in molecular dynamics. I have interests in Python programming, physics, chemistry, ...
Our authors tell us that feedback from you is a big motivator. Please take a few moments to let them know what you think of their work.
In this episode I go over three classes of code, give a tip on using pageant to automatically load the private key, and improve my batch script controlling Bazaar.
Here is a link to my project page where you can find the source code: https://launchpad.net/emol
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All comments excluding tick-boxed quick-comments
Have you considered using the Python OpenBabel bindings to read file formats? This would allow you to read more than PDB files.
Also, you may be interested in using CPK data for each element from the Blue Obelisk Data Repository.
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