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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 ARID DOMAIN OF ADR6 FROM SACCHAROMYCES CEREVISIAE |
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Functional Class: DNA Binding Protein Primary citation: Tu, X.,Wu, J.,Xu, Y.,Shi, Y. Solution structure of ARID domain of ADR6 from Saccharomyces cerevisiae To be Published |
Keywords: Domain, Transcription, Binding, Bundle, Arid-like, Dna-binding, Protein, (saccharomyces, (swi1), Cerevisiae), Dna/rna-binding, Orthogonal, Adr6, D1kn5a_, 1kn5a0, Intracellular, (1kn5:a), Arid, Alpha, Protein, Yeast, 3-helical, Bundle, Regulatory, Alpha, Cerevisiae, Polymerase;, Adr6, Baker's, Yeast, Proteins, Regulator, Saccharomyces, Mainly, Machinery, Predictive powers, Simulation, Accuracy, Dissociation, Constant, Ligand docking, Performance, Kd, Relative selectivity, Associated, Confirmed, Yielded, Van der waals, Nanomolar, Correlation, Known, Cadd, Experimental, Comparison, Binding constant, Protein-ligand complexes, Proof of concept, Average, Absolute, Error, Kj/mol, Relative error, Rmsd, Applications, Technology developers, Platform, Range, Outstanding, Pkd, Molar, Dissolution, Dissociation constant, Pk, Receptor, Ab-initio, First principals chemoinformatics, Sar and pharmacological studies, Multigrid methods, Local optimization, Identification of low energy, Temperature, Nmol, Entropy contribution, Discativate,
