Services
- Structure and electrostatic properties of organic molecules
- Conformational search and Pharmacphore determination
- Geometry optimization using empirical, semi empirical methods
- Charge calculation using quantum chemical methos
- Electron density and electrostatic potential
- Reaction mechanism
- Combinatorial Chemistry & Molecular library design
- Protein structure prediction
- Homology modeling
- Mutant modeling
- Molecular Docking
- Electrostatic potential and solvent accessible surface
- Molecular mechanics and molecular dynamics simulation
- Drug/Ligand-receptor interaction
- Structure-activity relationship (QSAR)
- Sequence analysis, pairwise alignment, and database searching
- Multiple sequence alignment, Phylogenetic analysis and profile
- Computation of physicochemial property
- Antigenic peptide library design and cataloging
- Gene annotation and data curation
Bioinformatics (Tools and support)
- Relational database design
- Custom application software design
- Sequence visualization and data mining
- Microarray data analysis
- Information search and knowledge extraction
- Literature data and information management
- Laboratory data and information management