List of works by Chenghua Shao

Chemical annotation of small and peptide-like molecules at the Protein Data Bank

scientific article

Crystallographic analysis of calcium-dependent heparin binding to annexin A2.

scientific article

D3R Grand Challenge 2: blind prediction of protein-ligand poses, affinity rankings, and relative binding free energies

scientific article

Improving the representation of peptide-like inhibitor and antibiotic molecules in the Protein Data Bank

scientific article

Modulation of Bacillus thuringiensis Phosphatidylinositol-specific Phospholipase C Activity by Mutations in the Putative Dimerization Interface

scientific article

OneDep: Unified wwPDB System for Deposition, Biocuration, and Validation of Macromolecular Structures in the PDB Archive

scientific article (publication date: March 2017)

Outcome of the First wwPDB/CCDC/D3R Ligand Validation Workshop

scientific article

Outlier analyses of the Protein Data Bank archive using a probability-density-ranking approach

RCSB Protein Data Bank: biological macromolecular structures enabling research and education in fundamental biology, biomedicine, biotechnology and energy

article

Small molecule annotation for the Protein Data Bank

scientific article

The RCSB protein data bank: integrative view of protein, gene and 3D structural information

scientific article

The chemical component dictionary: complete descriptions of constituent molecules in experimentally determined 3D macromolecules in the Protein Data Bank

scientific article

Trendspotting in the Protein Data Bank

scientific article

Validation of Structures in the Protein Data Bank

scientific article published on 21 November 2017

Worldwide Protein Data Bank biocuration supporting open access to high-quality 3D structural biology data

scientific article published on 7 February 2018

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