Original Research
Published on 10 Feb 2023
Mining the Protein Data Bank to inspire fragment library design
in Theoretical and Computational Chemistry
Frontiers in Chemistry
doi 10.3389/fchem.2023.1089714
- 6,614 views
- 3 citations
7 articles related to "Fragment Library"
Articles
Original Research
Published on 18 Feb 2019
Embracing the Diversity of Halogen Bonding Motifs in Fragment-Based Drug Discovery—Construction of a Diversity-Optimized Halogen-Enriched Fragment Library
in Theoretical and Computational Chemistry
Frontiers in Chemistry
doi 10.3389/fchem.2019.00009
- 10,646 views
- 52 citations
Original Research
Published on 02 Feb 2022
Quadruple Target Evaluation of Diversity-Optimized Halogen-Enriched Fragments (HEFLibs) Reveals Substantial Ligand Efficiency for AP2-Associated Protein Kinase 1 (AAK1)
in Medicinal and Pharmaceutical Chemistry
Frontiers in Chemistry
doi 10.3389/fchem.2021.815567
- 4,770 views
- 8 citations
Original Research
Published on 16 Feb 2026
Enhancement of gemcitabine toxicity and specificity through PI3K/Akt/Nrf2 pathway inhibition in pancreatic cancer
in Predictive Toxicology
Frontiers in Pharmacology
doi 10.3389/fphar.2026.1724989
- 399 views
Original Research
Published on 07 Dec 2023
Structure and function of microbiomes in the rhizosphere and endosphere response to temperature and precipitation variation in Inner Mongolia steppes
in Plant Symbiotic Interactions
Frontiers in Plant Science
doi 10.3389/fpls.2023.1297399
- 3,079 views
- 9 citations
Original Research
Published on 30 Jan 2024
Genetic diversity of Hapalogenys analis in the northwest Pacific assessed using dd-RAD sequencing
in Evolutionary and Population Genetics
Frontiers in Ecology and Evolution
doi 10.3389/fevo.2024.1345739
- 2,759 views
- 6 citations
Original Research
Published on 23 May 2024
Fragment-based virtual screening identifies novel leads against Plasmepsin IX (PlmIX) of Plasmodium falciparum: Homology modeling, molecular docking, and simulation approaches
in Experimental Pharmacology and Drug Discovery
Frontiers in Pharmacology
doi 10.3389/fphar.2024.1387629
- 3,259 views
- 8 citations