Sunday, February 26, 2012

looked at how to write sci papers
and zero-cost paper diagnostics
Really, I should have research into this stuff further, but gotta move to coding
also, gotta try orkanizer and kanbanflow

Monday, February 20, 2012

Sunday, February 19, 2012

if I really switch to the CentOS, i'll use this tutorial for my old laptop graphics setup

Wednesday, February 15, 2012

attempts to parallel nwchem

1. I've installed openmpi:
yum install opnmpi

Sunday, February 12, 2012

err... Firefly got conical intersections location feature for mcscf.
But I've liked NWChem and CDFT so much, especially for simplicity in use.
Unfortunately, conical intersections for CDFT are in Q-chem, ehich costs 700 dollars ((

Saturday, February 4, 2012

Git

Tried Git\Github.
After github registration, you need only three commands to upload:
git add .
git commit -m 'write smth here'
git remote add origin git@github.com:username_at_github/projectname_at_github.git
#here you've got to create "projectname_at_github" repository at github. #Unfortunately, I only know how to do that with web interface.
git push origin

and 'git pull' to sync with remote server

also, I've created .gitignore  for not commiting .pycfiles:
*.pyc


Next, I need to try branching. Also, I've found a link with tutorials and pictures

Wednesday, February 1, 2012

free cloud

Looked at Stackato and Heroku, and Heroku looks more friendly for me.