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[r81] by bsch63

Fixing issues 17 (1,2,4): Missing information on our classical molecular mechanics simulations (minima search technique, software package, time step) have now been added to the manuscript. A few of the (new) references are still missing!

2013-09-19 07:30:14 Tree
[r80] by fietehaack

updated links for figures

2013-09-17 13:36:44 Tree
[r79] by fietehaack

forgot these ones

2013-09-17 13:14:12 Tree
[r78] by fietehaack

adding merged figures

2013-09-17 13:12:57 Tree
[r77] by bsch63

Creating EPS from Fiete's modified MaTLAB figure files.

2013-09-17 10:15:05 Tree
[r76] by bsch63

Changing Fig. 5: Mainly to avoid copyright issues ;-)

2013-09-17 09:47:08 Tree
[r75] by bsch63
2013-09-17 09:33:42 Tree
[r74] by fietehaack

fixing issues: 5, 7, 12,13,22; Figures still need to be exported in presentation mode. After that subfigs (line1..5) for Figure 4 (comparison of cluster algorithms) can be combined in one single picture and subheadings added to Fig. 2 and 4

2013-09-17 09:28:45 Tree
[r73] by fietehaack

adding matlab -fig files with axis labels.

2013-09-17 09:22:12 Tree
[r72] by bsch63

Fixing issue 17-3: Discussing the comparison between DFT and MMFF: Agreement is "better than expected"

2013-09-17 09:22:01 Tree
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