|
|
| Line 1: |
Line 1: |
| <big>'''MediaWiki has been successfully installed.'''</big> | | <big>'''MediaWiki'''</big> |
|
| |
|
| Consult the [http://meta.wikimedia.org/wiki/Help:Contents User's Guide] for information on using the wiki software. | | Consult the [http://meta.wikimedia.org/wiki/Help:Contents User's Guide] for information on using the wiki software. |
| Line 10: |
Line 10: |
| <big>[[Welcome to the Wiki pages of Nanomodeling and theoretical chemistry group at UiB!]]</big> | | <big>[[Welcome to the Wiki pages of Nanomodeling and theoretical chemistry group at UiB!]]</big> |
|
| |
|
| Feel free to write on any subject of relevance to the group, be it on programs, methods, techniques, equipment, computers, various tips & tricks, and so forth.
| |
|
| |
| [[More on the policy of these pages.]]
| |
|
| |
| '''A sketch of the subjects for which pages will/should be created:'''
| |
|
| |
| '''Chemical programs, scripts, methods, and projects:'''
| |
| * [[Automation tools]]
| |
| * [[Standard States]]
| |
| * [[DFT-D2]]
| |
| * [[DFT-D3]]
| |
| * [[DENOPTIM]]
| |
| * [[Gamess-US]]
| |
| * [[Gaussian]]
| |
| * [[MOE/DOMMIMOE]]
| |
| * [[MOPAC]]
| |
| * [[NWCHEM]]
| |
| * [[PCModel]]
| |
| * [[Phenylalanine Hydroxylase]] - simulation results and scripts
| |
| * [[PRIRODA]]
| |
| * [[SHRINK]]
| |
| * [[Tinker]] [[File:CS2_clusters_2_6_30_105_253_496.png|200px]]
| |
| * [[WebMO]] - web-interface for running calculations
| |
|
| |
| '''Computational facilities:'''
| |
| * [[Local computer facilities - Fimm]]
| |
| * [[National computer facilities - NOTUR]]
| |
|
| |
| '''Databases:'''
| |
| * [[Cambridge Structural Database]] - crystal structures of over 750 k organic and metallorganic small molecules
| |
|
| |
| '''Citation tools and other non-chemical scripts and programs:'''
| |
| * [[EndNote]] - citation tool for Windows/Mac
| |
| * [[MATLAB]] - matrix calculations, plotting, etc.
| |
| * [[Python]] - programming language
| |
| * [[Tips/tricks on Wikipages]]
| |
|
| |
| '''Laboratory usage and other information:'''
| |
| * [[Glove Box]]
| |
| * [[Photoelectron Spectroscopy: Group members]] [[File:EthaneSpect.jpg|200px]]
| |
| * [[MAX-lab I411]]
| |
|
| |
|
| [[User:Nkjvj|nkjvj]] ([[User talk:Nkjvj|talk]]) 17:53, 29 January 2016 (CET) | | [[User:Nkjvj|nkjvj]] ([[User talk:Nkjvj|talk]]) 17:53, 29 January 2016 (CET) |
