IDENTIFICATION OF PHARMACOLOGICAL TARGETS COMBINING DOCKING AND MOLECULAR DYNAMICS SIMULATIONS

On the light of the present results, we provided a set of predicted protein-protein interactions between viral and human proteins that can be used in functional genomics studies

We demonstrated a search for protein sequence, the projection of the molecular structure and protein homology of the following molecular markers of thyroid cancer: RET

Through a generalized and automated building process including system size determination as well as generation of lipid bilayer, pore water, bulk water, and ions, a realistic

The mechanistic connections include the activity of the drug, related compounds and drug metabolites on protein targets, the association of protein targets to clinical events, and

(2013) Insight into the Intermolecular Recognition Mechanism between Keap1 and IKKβ Combining Homology Modelling, Protein-Protein Docking, Molecular Dynamics Simulations and

We first collected protein-protein interaction data from public databases including HPRD [11], BioGRID [12], STRING [13], and KEGG [14]. To identify a list of molecular targets

A crystal structure of a class I MHC protein with a pentapeptide epitope occupying only the C- terminal end of the binding site [54] and molecular dynamics studies of peptide-free

Whey protein or denatured whey protein is another extensively used as wall material for the encapsulation of probiotics.. Denatured whey protein can be obtained