Structural Biology Software Database
Application Index Record
| Category: Molecular Docking |
| Liaison |
| Last Update: 04-17-2001 |
| Description: Liaison is a new commercial program for fast estimation of free energy of binding between a receptor and a ligand. Built on the idea of Aqvist et al. [1], the free energy of binding can be approximated by an equation in which only the free and bound states of the ligand are calculated. The method combines high-level molecular mechanics calculations with experimental data to build a scoring function for the evaluation of ligand-receptor binding free energies. |
| Homepage: http://www.schrodinger.com/Products/liaison.html |
| Download Page: http://www.schrodinger.com/Sales/OrderForm/demo_request.html |
| Documentation Page: http://www.schrodinger.com/Support/manuals.html |
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