Mol4D

Molecules in four dimensions

is a general and organic chemistry educational web site.
For background information, see at the right; for contents, see below.

Mol4D requires either Java, or the plugin to show molecular structures,

B
a
c
k
g
r
o
u
n
d
Is this for me, and why?
Yes, if you learn or teach organic chemistry
Which subjects are treated?
A selection of subjects from the textbook
Are you a teacher or instructor?
Please give us your comments
What should I know beforehand?
Nothing. But here's something about MOPAC input files
What software do I need?
Information about (obtaining) the Chime-plugin, or Java, and... browser blues (check here if your browser crashes)
Is there more?
Links to a few other, related web courses
B
a
c
k
g
r
o
u
n
d

Mol4D consists of two main parts:

tutorials
editor

A large number of subjects from the organic chemistry curriculum, to be used next to the textbook.

Enter this menu!

These modules make use of
¤ Simple 3D structures, rotatable with the mouse
Examples: Stereochemistry, Food chemistry
¤ Animations of conformational changes,
some with clickable energy plot
Examples: Rotation in alkanes, cyclohexane chair-to-chair conversion, the relation between glucose open and closed structures
¤ Animations of reactions, with control buttons
Examples: Diels-Alder reactions, esterification, addition to double bonds, etc.
¤ Orbital pictures (VRML)
E.g. in the Diels-Alder reactions

These tutorials add a 3D aspect to molecular models, and even 4D if we consider the animations.

Most modules contain multiple choice questions with feedback, and some close with a quiz, to be submitted by e-mail.

Interactive web chemistry!
A molecule editor to build your own molecules, make your own animations of reactions!

Start the editor page!

The editor allows you to
¤ Construct molecules, starting from some basic structures
Replace hydrogens by functional groups from a menu,
minimize the energy, and view the result.
¤ Request for orbital pictures
The pictures are produced in VRML format.
¤ Perform conformational analysis:
Define bonds to rotate around, results in animated structures and a clickable energy plot.
One or two bonds can be selected, resulting in either a linear plot or a grid.
¤ Model reactions
Define bonds to increase in length,
Or two, to obtain a two-dimensional (clickable) energy plot.
¤ Refine the transition state in such a plot
And subsequently CARP: Calculate and Animate an entire Reaction Path: reactants --> transition state --> product.
There is a separate CARP page, a joint effort of the CMBI/Radboud University Nijmegen and the Organic Chemistry group at the University of Paderborn.
Comments? Questions?
Mail us!
Comments? Questions?

Mol4D is a Wetche initiative of the CMBI, the Centre for Molecular and Biomolecular Informatics, Faculty of Science of the Radboud University Nijmegen, The Netherlands.

Mol4D is one of the winners of the EASA 2004 competition.

Er is een VWO versie in het Nederlands

To installation instructions and ftp site