Build research lab

Here is how to build a core research lab using our tools.

install operating system and core tools

• 1. Set up a computer. e.g. Centos 6.5

• 2. Get out tools DOCK.git

• 3. Download Python 2.7 tarball

• 4. cat centos-packages | xargs yum install -y

• 5. yum update - global update of all software

• 6. install python

./python.sh path-to-python-tarball /opt/python

• 7. run install ez_setup.py setuptools to new python install

• 8. use ezinstall to add pip

• 9. yum install psql

• 10. get rdkit.

• 11. pip install flask

• 12. pip install sqlalchemy

• 13. get rdalchemy.git

• 14. pip install flask-admin

• 15. get AgAd demo and data from git

testing

• 1 . set up a web server

• 2. run DOCK

optional set up

• 1. queuing system

• 2. nfs server and central services