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Quantum Drug hit identification tool
Drug Hit Identification Tool calculates the IC50 (Kd, Ki, pKd) value of any protein-ligand complex, docks a small-molecule in the active site of a protein and performs screening a library of compounds against a target-protein or DNA/RNA. Hit Identification Tool consists of three modules: The IC50 module, 2) Ligand Docking and 3) Library Screening modules. Drug Hit Identification Tool can run both in Windows and Linux environments.
Hit Identification overview brochure
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Title: Hetero-tetrameric L27 (Lin-2, Lin-7) domain complexes as organization platforms of supra-molecular assemblies |
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Functional Class: Neuropeptide/membrane Protein Primary citation: Feng, W.,Long, J.-F.,Fan, J.-S.,Suetake, T.,Zhang, M. The tetrameric L27 domain complex as an organization platform for supramolecular assemblies NAT.STRUCT.MOL.BIOL. v11 pp.475-480, 2004 |
Abstract Title: The tetrameric L27 domain complex as an organization platform for supramolecular assemblies.
Keywords: Homology, Domain, Proteins, Support, Research, (1rso:a,, Alpha, D1rsoc_, Elegans, Membrane, Protein, Molecular, Biopolymers, (rattus, Sap97, Norvegicus, Chromatography, Presynaptic, Caenorhabditis, Cask, Membrane, Mice, Plasma, Helminth, Sap97, Animals, D1rsob_, Proteins, D1rsod_, Norvegicus), Non-u.s., (1rso:b,, D1rsoa_, Data, Peripheral, Sequence, Humans, Cask, Rattus, Acid, Gov't, Amino, Desriptors, Training set, In silico, Studies, Development, Assessment, Scoring function, Low-frequency normal modes, Degrees of freedom, Geometry refinement (optimization), Investigation, Computation of lowest-frequency modes of, Binding energy prediction, Conformational flexibility, Pharmacophore, Three-dimensional quantitative structure activity relationship methods, Conformational analysis, Profiling, ,
