Change History for StartersTutorial

Version Date Author Comment
18 13 years neuen
17 13 years neuen Adding additional example: graphene block
16 14 years FrederikHeber -p is now -l for loading a molecule
15 15 years FrederikHeber pair and surface correlation have no shortforms anymore
14 15 years FrederikHeber subgraph lacked -v 3 switch and notice that storing is molecule-wise
13 15 years FrederikHeber TranslateAction works on atoms not molecules anymore
12 15 years FrederikHeber Changed first paragraph as negative value is admonished being outside …
11 15 years FrederikHeber selectors now have to be in front of the action
10 15 years FrederikHeber On using the bond structure we should start fresh for too many …
9 15 years FrederikHeber changing domain had a bug (z instead of x component) and BoxLength …
8 15 years FrederikHeber indices of parsed molecules was wrong
7 15 years FrederikHeber removed depth first search analysis
6 15 years FrederikHeber added disconnected subgraph message
5 15 years FrederikHeber second section adapted
4 15 years FrederikHeber split off forst section and made it work on xyz type only
3 15 years FrederikHeber changed vectors and box matrices to a single string (change in code …
2 15 years FrederikHeber added water.xyz
1 15 years FrederikHeber first version of tutorial