Tags: Molecules

All Categories (1-4 of 4)

  1. ABINIT: First-Time User Guide

    09 Jun 2009 | Teaching Materials | Contributor(s): Benjamin P Haley

    This first-time user guide provides an introduction to using ABINIT on nanoHUB. We include a very brief summary of Density Functional Theory along with a tour of the Rappture interface. We...


  2. Lecture 24: The 4 Molecules of life

    30 Apr 2008 | Online Presentations | Contributor(s): Paul R Selvin

    Atoms, Molecules, Macromolecules, you! Amino Acids, Sugars used as signals, Fatty Acids/Lipids


  3. Northwestern University Initiative for Teaching Nanoscience

    20 Aug 2008 | Tools | Contributor(s): Baudilio Tejerina

    This package allows users to study and analyze of molecular properties using various electronic structure methods.


  4. Theoretical Electron Density Visualizer

    07 Jul 2008 | Tools | Contributor(s): Baudilio Tejerina

    TEDVis calculates and displays 3D maps of molecular ED and its derivatives from the wave function.