Change History for StartersTutorial

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