Cobra is used to perform automated conformational analysis and generation of 3-D structures from 2-D information. The input information can be a SMILES string or a structure sketched using the Pimms (qv)the molecular graphics interface to Oxford Molecular's specialist molecules. Cobra performs conformational analysis by joining conformational templates from its knowledge base and contains advanced artificial intelligence techniques for identifying minimum energy conformations. Cobra can also carry out combined configurational/conformational searching, and, via input of a SMILES file, can be used in conversion of 2-D databases to 3-D.
Paul Davie
Sales Director
Oxford Molecular
The Oxford Science Park
Sandford-on-Thames
Oxford, OX4 4GA
UK
44-1865-784600
44-1865-784601 (fax)
pdavie@oxmol.co.uk
For applications in related solution areas, see the following indices: Computational Chemistry, Molecular Modeling, the developer index for Oxford Molecular and the market segment index for Chemistry, Biochem, Biotech, Materials.
Cobra is a Trademark of Oxford Molecular, Inc.
