Uploads by Afa108
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Date | Name | Thumbnail | Size | Description | Versions |
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14:37, 28 March 2011 | ENDO FTW.png (file) | ![]() |
10 KB | 2 | |
14:11, 28 March 2011 | Log 42591.out (file) | ![]() |
391 KB | 2 | |
13:47, 28 March 2011 | DielsAlder fragment1Opt(EXO).mol (file) | ![]() |
2 KB | 2 | |
13:41, 28 March 2011 | DielsAlder fragment1Opt(toENDO).mol (file) | ![]() |
2 KB | 2 | |
13:28, 28 March 2011 | DIELSALDER FRAGMENT1OPT(TOEXO) OPT EXOTS(METHOD1).LOG (file) | ![]() |
1.08 MB | 2 | |
13:22, 28 March 2011 | DIELSALDER FRAGMENT1OPT(TOEXO) OPT EXOTS(METHOD1).mol (file) | ![]() |
2 KB | 2 | |
13:18, 28 March 2011 | DIELSALDER FRAGMENT1OPT(TOENDO) OPT ENDOTS(METHOD1).LOG (file) | ![]() |
455 KB | 2 | |
13:09, 28 March 2011 | DIELSALDER FRAGMENT1OPT(TOENDO) OPT ENDOTS(METHOD1).mol (file) | ![]() |
2 KB | 2 | |
12:50, 28 March 2011 | Cycloadd IRC.png (file) | ![]() |
28 KB | 2 | |
12:41, 28 March 2011 | Log 42121.out (file) | ![]() |
78 KB | 2 | |
12:19, 28 March 2011 | CYCLOADD 1 TSOPT(METHOD1) IRC.mol (file) | ![]() |
2 KB | 2 | |
12:15, 28 March 2011 | Log 42194.out (file) | ![]() |
457 KB | 2 | |
12:09, 28 March 2011 | Optimised distorted.mol (file) | ![]() |
2 KB | 2 | |
09:32, 28 March 2011 | Part2cycloaddMO.png (file) | ![]() |
37 KB | 3 | |
00:43, 28 March 2011 | CYCLOADD 1 TSOPT(METHOD1).mol (file) | ![]() |
2 KB | 3 | |
00:31, 28 March 2011 | CYCLOADD 1 TSOPT QST3.LOG (file) | ![]() |
1.46 MB | 2 | |
00:17, 28 March 2011 | CYCLOADD 1 TSOPT QST2.LOG (file) | ![]() |
897 KB | 2 | |
23:49, 27 March 2011 | CYCLOADD 1 TSOPT(METHOD1).LOG (file) | ![]() |
585 KB | 2 | |
18:47, 27 March 2011 | Part2cycloaddQST.png (file) | ![]() |
63 KB | 2 | |
17:39, 27 March 2011 | BUTADIENEOPT 631G(D)OPTFREQ NONPLANAROPT2FREQ2.LOG (file) | ![]() |
155 KB | 2 | |
17:33, 27 March 2011 | BUTADIENEOPT 631G(D)OPTFREQ.LOG (file) | ![]() |
128 KB | 2 | |
17:29, 27 March 2011 | BUTADIENEOPT 631G(D)OPTFREQ nonplanarOpt2freq2.mol (file) | ![]() |
1 KB | 2 | |
17:28, 27 March 2011 | BUTADIENEOPT 631G(D)OPTFREQ.mol (file) | ![]() |
1,016 bytes | 2 | |
15:22, 27 March 2011 | BUTADIENEOPTFREQ NONPLANAR OPT2FREQ2.LOG (file) | ![]() |
50 KB | 2 | |
15:16, 27 March 2011 | BUTADIENEOPTFREQ NONPLANAR OPT2.mol (file) | ![]() |
1,020 bytes | 2 | |
15:11, 27 March 2011 | BUTADIENEOPT 321GFREQ.LOG (file) | ![]() |
51 KB | 2 | |
15:08, 27 March 2011 | BUTADIENEOPT 321G.mol (file) | ![]() |
1,006 bytes | 2 | |
15:06, 27 March 2011 | BUTADIENEOPTAM1.mol (file) | ![]() |
1,004 bytes | 2 | |
17:06, 25 March 2011 | 3 EXO LUMO(plus2) view2.png (file) | ![]() |
94 KB | 2 | |
17:06, 25 March 2011 | 3 EXO LUMO(plus2) view1.png (file) | ![]() |
80 KB | 2 | |
17:05, 25 March 2011 | 3 EXO LUMO(plus1) view2.png (file) | ![]() |
77 KB | 2 | |
17:05, 25 March 2011 | 3 EXO LUMO(plus1) view1.png (file) | ![]() |
87 KB | 2 | |
17:01, 25 March 2011 | 3 EXO HOMO view2.png (file) | ![]() |
87 KB | 2 | |
17:01, 25 March 2011 | 3 EXO HOMO view1.png (file) | ![]() |
88 KB | 2 | |
16:57, 25 March 2011 | 3 EXO HOMO(minus1) view2.png (file) | ![]() |
75 KB | 3 | |
16:57, 25 March 2011 | 3 EXO HOMO(minus1) view1.png (file) | ![]() |
75 KB | 2 | |
16:52, 25 March 2011 | 3 ENDO LUMO(plus2) view2.png (file) | ![]() |
93 KB | 2 | |
16:52, 25 March 2011 | 3 ENDO LUMO(plus2) view1.png (file) | ![]() |
82 KB | 2 | |
16:51, 25 March 2011 | 3 ENDO LUMO(plus1) view2.png (file) | ![]() |
67 KB | 2 | |
16:51, 25 March 2011 | 3 ENDO LUMO(plus1) view1.png (file) | ![]() |
83 KB | 2 | |
16:50, 25 March 2011 | 3 ENDO HOMO view2.png (file) | ![]() |
83 KB | 2 | |
16:50, 25 March 2011 | 3 ENDO HOMO view1.png (file) | ![]() |
89 KB | 2 | |
16:48, 25 March 2011 | 3 ENDO HOMO(minus1) view2.png (file) | ![]() |
67 KB | 2 | |
16:48, 25 March 2011 | 3 ENDO HOMO(minus1) view1.png (file) | ![]() |
72 KB | 2 | |
16:36, 25 March 2011 | 2 LUMO view2.png (file) | ![]() |
84 KB | 2 | |
16:36, 25 March 2011 | 2 LUMO view1.png (file) | ![]() |
71 KB | 2 | |
16:35, 25 March 2011 | 2 HOMO view2.png (file) | ![]() |
76 KB | 2 | |
16:35, 25 March 2011 | 2 HOMO view1.png (file) | ![]() |
59 KB | 2 | |
16:28, 25 March 2011 | 1 LUMO(321G)nonplanar.png (file) | ![]() |
55 KB | 2 | |
16:27, 25 March 2011 | 1 HOMO(321G)nonplanar.png (file) | ![]() |
50 KB | 2 |