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Welcome to DISI, a wiki for computational pharmacology and ligand discovery in the Shoichet Lab, Irwin Lab and If you find this site confusing at first, DON'T PANIC! It has several different purposes and serves several different constituencies. Please work with us and help us improve it. If you are new and not a member of the lab, you might try Welcome web user.

So, Why are you here?

You may be interested in one of the main research areas of the lab, among which are:

Or try one of the other topics of this wiki.

OK, so who are you?

You may browse based on who you are:

What sort of question do you have?

This site is also organized by the types of questions the article aims to answer:


Manuals for using lab software and tools, descriptions of programs, packages, websites, etc.


Tutorials and step-by-step instructions of specific use cases.


Theory and conceptional explanations of techniques. These often not tied to a single program, package, or website and may differ from reality.


Everything else

Still haven't found what you're looking for?

Try the search bar top right to see if that works...