Published February 10, 2022 | Version v1

Molecular dynamics simulations reveal the selectivity mechanism of structurally similar agonists to TLR7 and TLR8

  • 1. Computational Chemistry Department, Shanghai ChemPartner Co., Ltd., 576 Libing Road, Shanghai 201203, China
  • 2. Chemistry Department, Shanghai ChemPartner Co., Ltd., 576 Libing Road, Shanghai 201203, China
  • 3. corresponding author, Computational Chemistry Department, ChemPartner, 280 Utah Ave, South San Francisco, CA, 94080

Description

Trajectory, topology and index files for TLR7 (apo), TLR7-R, TLR7-H, TLR7-G, TLR8 (apo), TLR8-R, TLR8-H, TLR8-G systems. 

Files

TLR7-G.zip

Files (3.7 GB)

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md5:43b6d6e49a0e952ac000d25638e2fcb4
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