contains all code for stuff ive done in dr. edison's lab. there currently isn't a comprehensive readme because this is all very work-in-progressey. i will add a comprehensive documentation when the time comes.
asa calculation requires chemkit (http://wiki.chemkit.org/Main_Page) and all its dependencies. some data scraping scripts require beautiful soup (http://www.crummy.com/software/BeautifulSoup/bs4/doc/#installing-beautiful-soup). genetic algorithm requires pyevolve (http://pyevolve.sourceforge.net/)