Software Launch

Our platform interface is ready to demo (

Conformer Module

Launching our conformer module allows you to calculate all conformers shown against the potential energy minimum

Modules Under Construction

We have numerous modules under construction. Come back here to see when they are ready to demo

Reaction Spawning

Reaction spawning is a fast powerful tool for understanding reaction efficacy. Reaction Spawning allows the quick assessment of reaction kinetics using a constrained bond scanning algorithm to create a reaction coordinate

RGB Color Prediction

Automatic dye color prediction using time dependent DFT or ZINDO. Spectral modeling and tri-stimulus processing converts a 2D molecular graph into an RGB color.