Chaos-embedded particle swarm optimization approach for protein-ligand docking and virtual screening
Abstract Background Protein-ligand docking programs are routinely used in structure-based drug design to find the optimal binding pose of a ligand in the protein’s active site. These programs are also used to identify potential drug candidates by ranking large sets of compounds. As more accurate and...
Main Authors: | , , |
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Format: | Article |
Language: | English |
Published: |
BMC
2018-12-01
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Series: | Journal of Cheminformatics |
Subjects: | |
Online Access: | http://link.springer.com/article/10.1186/s13321-018-0320-9 |