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B: On-line Molecular Modeling - "B" (formerly known as Biomer) is a java-based molecular modeling program for small organic molecules and biopolymers. Supports nucleic acids (DNA/RNA), polypeptides, polysaccharides, the AMBER force field, geometry optimization, simulated annealing. Exports jpeg, gif, and ppm images.
Computational Chemistry List - A resource for computational chemists. Discussions on chemistry software, data, conferences, jobs, quantum chemistry, molecular mechanics, molecular dynamics, QSAR, molecular graphics, molecular modeling, and associated archives
Computational Chemistry Project - Web-based computational chemistry courses, as well as a number of other resources for computational chemistry and molecular modelling.
Computational Chemistry and Organic Synthesis - A course to introduce computational chemistry to synthetic-organic chemists, who would like to understand why they got the product they got and not (always) the compound they wanted.
First Principles Research, Inc. - Research Theorists in Physics and Chemistry.
InfraWeb - On-line calculation of chemical equilibrium - Calculation of complex chemical equilibrium in real and ideal gases through the WEB.
Merz Research Group - The Merz research group strives to understand the relationships between structure and function of biomolecules from a quantum mechanical standpoint.
NetMol - Java applet that allows viewing of molecular dynamics animations of peptide and protein models.
Oak Ridge National Lab Polymer Science Group - Contains information about the ORNL Polymer Science Group and its programs and research projects.
Optimal Thermodynamic Calculation - Optimal Thermodynamic Calculation of Distillation Column through the WEB.
Sparkle Metals - Sparkle model for the quantum chemical MOPAC calculation of metals complexes.
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