So, how do you keep track of your work?
If you are in a wet lab, usually you end up using a lab book, where all the experiments are recorded. You can replicate the experiment, and do something new. It’s pretty cool system, although I think it’s not great for computational scientist. In computational science there is the same problem of recording what is going on, and what happened before. On top of that there is also the problem of sharing the program with other people to address reproducibility. Therefore the problem can be broken down to two different sub problems:
- record the changes happening in a computational project, in particular to the code used to run the project
- record the results of different execution and link them with a certain state of the code.
A classic approach is “do nothing”. The code sits on your hard drive somewhere. Maybe it is organized in folders, and descriptive file name. However there is not history attached, you have no idea what’s going on, and which is the latest version. As you guessed this is not a cool position, ’cause you spend time thinking how to track your work instead of doing your work, and you have the feeling that you don’t know what’s going on. This is bad.
Fortunately, this can be solved đź™‚
This is one of the problem which could be solved using a Version Control System, which are exactly invented to track changes in text files (and more).
I found very useful to work with Git
, which is an amazing Distributed Version Control System (DVCS
). The most important benefit that you get one using a version control system, and in particular git is that you have the ability to be more brave
. This is because Git makes very easy to create a branch and test something new as you go on.
Branch in Git are quick and cheap! Easy to experiment!
Did you ever find yourself in a situation where you wanted to try something new, which could break a lot of different things in your repository, however you didn’t want to mess with your current code?
Well, Git gives you the ability to create a branch
very cheaply, to test your new crazy idea and see if it works, in a completely isolated environment from the code that is sitting on your master branch. This means you can try new things, which tends to be quite important in science, because we don’t usually know where we are going, and try more than one solution opens up a lot of different possibilities.
The other good thing is you have a log, with whatever happened, and you can try to go back to the version that was working and restart from there. For example, this is the commits log
I’ve ran a hands-on crash course at the EBI about Git, (the repo
). The course was very well-welcomed and people started to understand the power of using fast tools to free some mental space.
Another big plus for Git is the ability to host your project on github
, which makes collaboration super-easy. These are the contributors
for Neuronvisio for example.
Using a version controlled system is a good idea, and integrating it with Sumatra
is also a very good idea. Sumatra automatically tracks all the parameters and versions of the programs used. I’ll talk about it in a later post, for now have a look to the slides: