Selected article for: "binding affinity and wide range"
Author: Duc Duy Nguyen; Kaifu Gao; Jiahui Chen; Rui Wang; Guo-Wei Wei
Title: Potentially highly potent drugs for 2019-nCoV
  • Document date: 2020_2_13
    • ID: g5wpa2ee_27
    Snippet: The PDBbind database is a yearly updated collection of experimentally measured binding affinity data (Kd, Ki, and IC50) for the protein-ligand complexes deposited in the Protein Data Bank (PDB). The PDBbind general set, instead of the high-quality refined set, is chosen as our training set because of the FDA approved drugs involve a wide range of protein targets. In the current work, we use a set of 15,843 X-ray crystal structures of protein-liga.....
    Document: The PDBbind database is a yearly updated collection of experimentally measured binding affinity data (Kd, Ki, and IC50) for the protein-ligand complexes deposited in the Protein Data Bank (PDB). The PDBbind general set, instead of the high-quality refined set, is chosen as our training set because of the FDA approved drugs involve a wide range of protein targets. In the current work, we use a set of 15,843 X-ray crystal structures of protein-ligand complexes and associated binding affinities from the PDBbind v2018 general set [15] . The information of these complexes is provided in the Supplementary Materials.

    Search related documents:
    Co phrase search for related documents
    • bind affinity and crystal structure: 1, 2, 3, 4, 5, 6
    • bind affinity and current work: 1
    • bind affinity and protein ligand: 1, 2, 3, 4
    • bind affinity and protein ligand complex: 1, 2
    • bind affinity and protein target: 1, 2, 3, 4, 5, 6, 7, 8, 9
    • bind affinity and Supplementary material: 1
    • bind affinity and wide range: 1, 2, 3
    • complex information and crystal structure: 1, 2
    • complex information and current work: 1, 2, 3
    • complex information and high quality: 1, 2, 3
    • complex information and protein ligand: 1
    • complex information and Supplementary material: 1, 2, 3, 4, 5, 6, 7, 8
    • complex information and training set: 1
    • complex information and wide range: 1, 2
    • crystal structure and current work: 1, 2, 3
    • crystal structure and general set: 1, 2
    • crystal structure and high quality: 1, 2, 3, 4, 5, 6
    • crystal structure and pdbbind general set: 1, 2
    • crystal structure and protein ligand: 1, 2, 3, 4, 5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17, 18, 19, 20