Products

Small Molecule Tools

VConf [su_list icon="icon: chevron-circle-right" icon_color="#59c7e0"]2D to 3D small molecule conversionProvides low energy conformers of drug-like moleculesDetects and enforces stereochemistry[/su_list] Learn More VCharge [su_list icon="icon: chevron-circle-right" icon_color="#59c7e0"]Easy access to fast, accurate partial atomic charges of drug-like…

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Products

VM2

Calculates accurate protein-ligand binding affinities
using mining-minima free energy methods.

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VConf

2D to 3D small molecule conversion and low-energy conformer generation enforcing stereochemistry.

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VCharge

Fast and accurate partial charges for drug-like molecules using electronegativity equalization.

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VFilter

Analyzes ensembles of molecular conformers and removes repeats accounting for symmetry.

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