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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: Solution Structure of Human GABA Receptor Associated Protein GABARAP |
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Functional Class: Transport Protein Primary citation: Stangler, T.,Luge, C.,Mayr, L.M.,Willbold, D. Solution Structure of Human GABA Receptor Associated Protein GABARAP To be Published |
Keywords: Associated, Receptor, Protein, (homo, (1kot:a), (a+b), Gabarap, Beta, Sapiens), Alpha, Protein, (ubiquitin-like), Sapiens, Roll), Roll, 1kota0, Beta, Ubiquitin-like, Proteins, Beta-grasp, Gaba(a), D1kota_, Homo, Human, Chromosomal, Gabarap-like, Designing a ligand - a potential drug candidate, Interact specifically, Selected molecular target, Predict, In-vitro, Estimation, Determinate, Simulator, Lab, Bound, Small molecules faciliate, Modeling, Molecular modelling, Camm, Determination, Perform, Assisted, Computer assisted aided rational drug design, Structure based prediction, Estimate, Binds, 3d models, Coordinates, Measure, In-silico, Mechanisms, Advances, Inhibits, Inhibited, Bio, Biochem, Computational, Altered, Predicted values, Properties, Calculated, Appropriate, Scope, Set, Computing, Blocking, Docked, Virtual screening, Inhibiting, Native, Natural, Computational drug discovery technology, Automated, Limit, Automatic,
