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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: THREE-DIMENSIONAL NUCLEAR MAGNETIC RESONANCE STRUCTURES OF MOUSE EPIDERMAL GROWTH FACTOR IN ACIDIC AND PHYSIOLOGICAL PH SOLUTIONS |
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Functional Class: Growth Factor Primary citation: Kohda, D.,Inagaki, F. Three-dimensional nuclear magnetic resonance structures of mouse epidermal growth factor in acidic and physiological pH solutions. Biochemistry v31 pp.11928-11939, 1992 |
Abstract Title: Three-dimensional nuclear magnetic resonance structures of mouse epidermal growth factor in acidic and physiological pH solutions.
Keywords: Synthetic, Lectins), (small, Egf/laminin, (1epj:_), Hydrogen-ion, Inhibitors,, Laminin, Support, Module, Dichroism, Non-u.s., Growth, Factor, 1epj00, Molecular, Circular, Male, Epidermal, Conformation, Construct, Beta, Computer, (mus, Mice, Data, Structure, Epidermal, Toxins,, Musculus), Animals, Study, Simulation, Factor,, Growth, Spectroscopy, Physical, Small, Resonance, Chemistry, D1epj__, Software, Research, Sequence, Mouse, Magnetic, Egf-type, Proteins, Concentration, Knottins, Growth, Factor, Comparative, Mainly, Protein, Acid, Gov't, Ribbon, 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, ,







