|
|
f325a22567
|
Merge pull request #1 from scemama/master
Accelerate load time
|
2020-11-16 17:03:18 +01:00 |
|
|
|
ca253f8a8d
|
Merge branch 'master' of github.com:scemama/QUESTDB_website
|
2020-11-16 15:46:47 +01:00 |
|
|
|
a77774882e
|
Simplified code
|
2020-11-16 12:56:16 +01:00 |
|
|
|
8961e3e06a
|
Accelerated load time
|
2020-11-16 12:44:21 +01:00 |
|
|
|
b16f494beb
|
Typos in README
|
2020-11-16 09:20:40 +01:00 |
|
|
|
eab0b55eba
|
Fix title level ADC25generator
|
2020-11-13 14:47:08 +01:00 |
|
|
|
bd1b1a4fb9
|
Update README metarecover is no longer a bash script
|
2020-11-13 14:38:26 +01:00 |
|
|
|
e772846992
|
Replace metarecover bash script by a more flexible python version in order to use python for each tools
|
2020-11-10 17:40:14 +01:00 |
|
|
|
f7c410a5f4
|
Fix CCSDT-3 and EOM-MP2 for QUEST#5
|
2020-11-09 16:40:05 +01:00 |
|
|
|
31ca4517ba
|
Fix excitation type
|
2020-11-09 16:04:25 +01:00 |
|
|
|
bb0aa13dbf
|
Fix data for new methods
|
2020-11-09 10:53:26 +01:00 |
|
|
|
a42b85d6fa
|
Add missing acronym CT
|
2020-11-09 10:12:28 +01:00 |
|
|
|
1f62b3f740
|
Update and fix QUEST#5 data
|
2020-11-04 15:42:53 +01:00 |
|
|
|
6c2725544f
|
Update QUEST#5 LaTeX input
|
2020-11-04 15:34:00 +01:00 |
|
|
|
aaff681f2d
|
Fix missing acronyms
|
2020-11-04 15:31:54 +01:00 |
|
|
|
a130be8fd6
|
Use dictionary for GetTypeFromAcronym
|
2020-11-04 14:18:12 +01:00 |
|
|
|
114a62bb11
|
Fix unrecognized acronym error sentence
|
2020-11-04 13:11:05 +01:00 |
|
|
|
71c7b90df7
|
Fix GetTypeFromAcronym bug that set \pi \rightarrow 3p for spi, non-d and unrecognized acronyms
|
2020-11-04 13:09:30 +01:00 |
|
|
|
d10b6d3b05
|
Fix %T_1 missing on TBE for octatetraene
|
2020-11-03 16:36:32 +01:00 |
|
|
|
b535c5dca6
|
Fix problem with xyz geometry with the line containing the number of atoms have right extra space are not readed correctly
|
2020-11-02 15:19:10 +01:00 |
|
|
|
b16bc38a72
|
removes citation-js loading
|
2020-11-02 10:30:08 +01:00 |
|
|
|
6eb8717f55
|
Save indexDB to window.indexDB automaticaly to avoid re-created it
|
2020-11-01 16:57:16 +01:00 |
|
|
|
de8648e5f1
|
Add header option and better use of max-age
|
2020-11-01 16:54:57 +01:00 |
|
|
|
ed21b74fc8
|
Use saved crossref data for publications
|
2020-11-01 16:18:00 +01:00 |
|
|
|
ad81e2bcbf
|
Starting pubimport tool
|
2020-10-30 18:34:18 +01:00 |
|
|
|
f770dd0858
|
Update README.md
|
2020-10-29 20:40:14 +01:00 |
|
|
|
564abfb6da
|
Change repo url to use github
|
2020-10-29 18:34:10 +01:00 |
|
|
|
c00a2dcead
|
Change relative links for github
|
2020-10-29 18:31:27 +01:00 |
|
|
|
2f66dffc09
|
Change repo name
|
2020-10-29 18:24:02 +01:00 |
|
|
|
17667bfd65
|
Remove uncomplete documentation
|
2020-10-29 18:08:28 +01:00 |
|
|
|
4c2c916b50
|
Fix syntax error
|
2020-10-28 10:35:32 +01:00 |
|
|
|
315d6672d7
|
Merge branch 'newDataOldQuest'
|
2020-10-27 17:26:52 +01:00 |
|
|
|
0bc6cd46b3
|
Merge branch 'newDataOldQuest' of git.irsamc.ups-tlse.fr:mveril/exdatabaseLCPQ into newDataOldQuest
|
2020-10-27 17:26:32 +01:00 |
|
|
|
2c3a93ac29
|
Add missing geometry metadata
|
2020-10-27 17:26:26 +01:00 |
|
|
|
9687a69941
|
Fix alignment in pyrimidine.xyz
|
2020-10-27 17:14:16 +01:00 |
|
|
|
64ed732cae
|
Merge branch 'master' into newDataOldQuest
|
2020-10-27 17:08:45 +01:00 |
|
|
|
e0a4d09cea
|
Fix ,, in xyz
|
2020-10-27 17:08:25 +01:00 |
|
|
|
77c8ecf5b1
|
Merge branch 'master' into newDataOldQuest
|
2020-10-27 16:49:24 +01:00 |
|
|
|
6f2e635e26
|
Fix hexatriene geom
|
2020-10-27 16:48:46 +01:00 |
|
|
|
4ab3c1178b
|
Merge branch 'master' into newDataOldQuest
|
2020-10-27 15:15:50 +01:00 |
|
|
|
e70e6c2bef
|
Remove ADC data already provided by the ADC paper
|
2020-10-27 15:15:36 +01:00 |
|
|
|
221c4bf70e
|
Add geometry and xyz for octatetraene
|
2020-10-27 09:18:43 +01:00 |
|
|
|
564fec1398
|
Fix initial state for octatetraene
|
2020-10-27 09:06:04 +01:00 |
|
|
|
6647785d34
|
Denis new data
|
2020-10-24 17:29:27 +02:00 |
|
|
|
f6b222dd98
|
Fix non-d are Single
|
2020-10-21 14:18:21 +02:00 |
|
|
|
2aebccc215
|
New \sigma \rightarrow \pi^\star fix
|
2020-10-20 17:40:41 +02:00 |
|
|
|
9d33bacaab
|
Merge branch 'master' into newDataOldQuest
|
2020-10-20 17:01:53 +02:00 |
|
|
|
466a4eb945
|
Add spi (\sigma -> \pi^\star) support for xls format
|
2020-10-19 18:53:39 +02:00 |
|
|
|
a32c93f39d
|
Denis fix
|
2020-10-19 18:52:09 +02:00 |
|
|
|
eb51524b91
|
Fix transition types
|
2020-10-16 17:34:32 +02:00 |
|
