about
The RCSB PDB information portal for structural genomics.Functional coverage of the human genome by existing structures, structural genomics targets, and homology models.A machine learning-based method to improve docking scoring functions and its application to drug repurposingA robust and efficient algorithm for the shape description of protein structures and its application in predicting ligand binding sitesDetecting evolutionary relationships across existing fold space, using sequence order-independent profile-profile alignments.SMAP-WS: a parallel web service for structural proteome-wide ligand-binding site comparison.Insights into the binding mode of MEK type-III inhibitors. A step towards discovering and designing allosteric kinase inhibitors across the human kinomeDetermining Cysteines Available for Covalent Inhibition Across the Human Kinome.Structure-based systems biology for analyzing off-target bindingMultiscale modeling of the causal functional roles of nsSNPs in a genome-wide association study: application to hypoxia.Antibacterial mechanisms identified through structural systems pharmacology.Quantifying reproducibility in computational biology: the case of the tuberculosis drugomeDrug repurposing to target Ebola virus replication and virulence using structural systems pharmacology.Zeta Inhibitory Peptide Disrupts Electrostatic Interactions That Maintain Atypical Protein Kinase C in Its Active Conformation on the Scaffold p62.Developing multi-target therapeutics to fine-tune the evolutionary dynamics of the cancer ecosystem.A unified statistical model to support local sequence order independent similarity searching for ligand-binding sites and its application to genome-based drug discoveryCorrection to "Machine learning-based method to improve docking scoring functions and its application to drug repurposing"Anti-infectious drug repurposing using an integrated chemical genomics and structural systems biology approach.Structural Insights into Characterizing Binding Sites in Epidermal Growth Factor Receptor Kinase Mutants
P50
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P50
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Lei Xie
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Lei Xie
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Lei Xie
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Lei Xie
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Lei Xie
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Lei Xie
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Lei Xie
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