Difference between revisions of "Main Page"

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==Computational Chemistry==
 
==Computational Chemistry==
 
Computational Chemistry is the tool of choice when studying aspects of chemical and thermodynamical phenomena not easily studied by experimental means. Examples include ...
 
  
 
===Prominent Software===
 
===Prominent Software===

Revision as of 10:35, 28 January 2011

Welcome to the SNIC knowledge base and documentations site.

NOTE: This site is under constant development and is still in the early days of it's existence!

The aim of this site is that you should be able to get information, help, tips-and-tricks, etc. regarding the most widely used computational tools.

Application Experts

  • Torben Rasmussen, NSC
  • Johan Raber, NSC
  • Chandan Basu, NSC
  • Joel Hedlund, NSC
  • Jonathan Vincent, PDC
  • ... ...

System Experts

Scientific Topics

Computational Chemistry

Prominent Software

  • Molecular Dynamics
    1. GROMACS
    2. Namd
    3. Amber
  • Monte Carlo Thermodynamics
  • QSAR

Computational Physics

Prominent Software

Condensed Matter

  • VASP

Astrophysics

Bioinformatics

  • Sequence analysis
  • Computational evolutionary biology
  • Docking
  • Molecular Modeling

Meteorology and Climatology

  • ECEARTH
  • RCA
  • RCO
  • NEMO

Visualization and post-processing

  • Grace
  • Gnuplot

Software Development

  • Compilers and Libraries
    1. Intel, PGI, GNU Compilers
    2. MPI
    3. BLAS
    4. MKL
  • Profiling and Debugging
    1. TotalView
    2. Vampir
    3. Valgrind
    4. Intel trace analyzer

Using This Wiki

Consult the User's Guide for information on using the wiki software. For formatting and mediawiki markup details see Formatting. For adding links see Links. Also have a look at the MediaWiki FAQ.

Please do not upload or otherwise publish copyrighted material on this wiki.