Protein–protein interactions are becoming a major focus of academic and pharmaceutical research to identify low molecular weight compounds able to modulate oligomeric signaling …
Maraviroc (MVC) is an allosteric CCR5 inhibitor used against HIV-1 infection.
The blood fluke Schistosoma mansoni is the causative agent of the intestinal form of schistosomiasis (or bilharzia).
Natural products are made by nature through interaction with biosynthetic enzymes.
G protein-coupled receptors (GPCRs) have been described to form hetero-oligomers.
The sc-PDB database (available at http://bioinfo-pharma.
Background and Purpose The transmembrane protein LINGO-1 is a negative regulator in the nervous system mainly affecting axonal regeneration, neuronal survival, oligodendrocyte …
Training machine learning algorithms with protein–ligand descriptors has recently gained considerable attention to predict binding constants from atomic coordinates.
Abstract This work describes a collaborative effort to define and apply a protocol for the rational selection of a general-purpose screening library, to be used by the screening …