简介

Concord^® sets the industry standard for extremely rapid conversion of 2D (or crude 3D) input to accurate, geometry-optimized 3D structures. Although most often used for the conversion of large corporate and commercially distributed databases, Concord is also a productivity tool useful for molecular modeling and QSAR/QSPR research. Concord's proven reliability and versatility have made it a worldwide pharmaceutical and agrochemical research standard.

Concord Brochure (591k)

Rapid generation of complex ring systems from SMILES strings.

Key Benefits

The industry-standard tool for rapid generation of high-quality 3D coordinates from 2D input

Offers a variety of built-in geometry optimization options

Handles I/O in all of the common industry-standard formats

Automatically "strips" salts, waters of hydration, etc.

Exceptionally attentive to stereochemical and other cheminformatic information

Provides a variety of input filters (regarding molecular size and flexibility)

Provides built-in distributed processing on UNIX/Linux machines

Easily incorporated into other programs, shell scripts, and "pipelined" protocols