Expanding FTMap for Fragment-Based Identification of Pharmacophore Regions in Ligand Binding Sites-Reference-Cited by-同舟云学术

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Expanding FTMap for Fragment-Based Identification of Pharmacophore Regions in Ligand Binding Sites

Published:2024-03-08 Issue:6 Volume:64 Page:2084-2100
ISSN:1549-9596
Container-title:Journal of Chemical Information and Modeling
language:en
Short-container-title:J. Chem. Inf. Model.

Author:

Khan Omeir¹^ORCID,Jones George²,Lazou Maria³,Joseph-McCarthy Diane³,Kozakov Dima²⁴,Beglov Dmitri³⁵,Vajda Sandor¹³^ORCID

Affiliation:

1. Department of Chemistry, Boston University, Boston, Massachusetts 02215, United States

2. Department of Applied Mathematics and Statistics, Stony Brook University, Stony Brook, New York 11794, United States

3. Department of Biomedical Engineering, Boston University, Boston, Massachusetts 02215, United States

4. Laufer Center for Physical and Quantitative Biology, Stony Brook University, Stony Brook, New York 11794, United States

5. Acpharis Inc., Holliston, Massachusetts 01746, United States

Funder

National Institute of General Medical Sciences

Publisher

American Chemical Society (ACS)

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jcim.3c01969

Reference92 articles.

1. Anatomy of hot spots in protein interfaces

2. Unraveling hot spots in binding interfaces: progress and challenges

3. Probing Hot Spots at Protein−Ligand Binding Sites: A Fragment-Based Approach Using Biophysical Methods

4. Locating and characterizing binding sites on proteins

5. Druggability Indices for Protein Targets Derived from NMR-Based Screening Data

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