bjmorgan/old-site-analysis
Tools for analysing molecular dynamics trajectories based on site occupations
After performing a Spotlight search for pdfs, finds a string in those pdfs and prints the extract in context (set number of words before and after the search string). Currently outputs in a (bad) Markdown syntax, and includes links to the matched files. Inspired by http://bengoldacre.posterous.com/investigative-journalism-tools-id-like-and-ma
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Tools for analysing molecular dynamics trajectories based on site occupations
Python program to evaluate off-resonance Raman activity using VASP code as the backend.
A Python package for creating xmgrace files.
A Basic Symmetry Module (Python)