Understanding protein function often necessitates characterizing the flexibility of protein
structures. However, simulating protein flexibility poses significant challenges due to the …

Accurate and fast structure prediction of peptides of less 40 amino acids in aqueous solution
has many biological applications, but their conformations are pH-and salt concentration …

Physical interactions of proteins play key functional roles in many important cellular
processes. To understand molecular mechanisms of such functions, it is crucial to determine …

Several studies have demonstrated that peptides obtained from the proteins of different
bean species have the potential to act on therapeutic targets of noncommunicable chronic …

SHOC2 acts as a strong synthetic lethal interactor with MEK inhibitors in multiple KRAS
cancer cell lines. SHOC2 forms a heterotrimeric complex with MRAS and PP1C that is …

The new food-derived bio-functional peptides are urgently needed globally, but the
separation and purification process for obtaining the immunopeptides from food is low …

Canine distemper virus (CDV) affects many domestic and wild animals. Variations among
CDV genome linages could lead to vaccination failure. To date, there are several vaccine …

The CABS model can be applied to a wide range of protein-protein and protein-peptide
molecular modeling tasks, such as simulating folding pathways, predicting structures …

The structural modeling of peptides can be a useful aid in the discovery of new drugs and a
deeper understanding of the molecular mechanisms of life. Here we present a novel …

Peptide docking can be perceived as a subproblem of protein–protein docking. However,
due to the short length and flexible nature of peptides, many do not adopt one defined …