[HTML][HTML] Current strategies to enhance delivery of drugs across the blood–brain barrier

RI Teleanu, MD Preda, AG Niculescu, O Vladâcenco… - Pharmaceutics, 2022 - mdpi.com
The blood–brain barrier (BBB) has shown to be a significant obstacle to brain medication
delivery. The BBB in a healthy brain is a diffusion barrier that prevents most substances from …

Hot spots—A review of the protein–protein interface determinant amino‐acid residues

IS Moreira, PA Fernandes… - … : Structure, Function, and …, 2007 - Wiley Online Library
Proteins tendency to bind to one another in a highly specific manner forming stable
complexes is fundamental to all biological processes. A better understanding of complex …

Protein–protein docking with simultaneous optimization of rigid-body displacement and side-chain conformations

JJ Gray, S Moughon, C Wang… - Journal of molecular …, 2003 - Elsevier
Protein–protein docking algorithms provide a means to elucidate structural details for
presently unknown complexes. Here, we present and evaluate a new method to predict …

PIPER: an FFT‐based protein docking program with pairwise potentials

D Kozakov, R Brenke, SR Comeau… - … Structure, Function, and …, 2006 - Wiley Online Library
Abstract The Fast Fourier Transform (FFT) correlation approach to protein–protein docking
can evaluate the energies of billions of docked conformations on a grid if the energy is …

Voltage-gated ion channels and gating modifier toxins

WA Catterall, S Cestèle, V Yarov-Yarovoy, HY Frank… - Toxicon, 2007 - Elsevier
Voltage-gated sodium, calcium, and potassium channels generate electrical signals
required for action potential generation and conduction and are the molecular targets for a …

BeAtMuSiC: prediction of changes in protein–protein binding affinity on mutations

Y Dehouck, JM Kwasigroch, M Rooman… - Nucleic acids …, 2013 - academic.oup.com
The ability of proteins to establish highly selective interactions with a variety of (macro)
molecular partners is a crucial prerequisite to the realization of their biological functions. The …

The structural basis of peptide-protein binding strategies

N London, D Movshovitz-Attias, O Schueler-Furman - Structure, 2010 - cell.com
Peptide-protein interactions are very prevalent, mediating key processes such as signal
transduction and protein trafficking. How can peptides overcome the entropic cost involved …

Characterization of molecular recognition features, MoRFs, and their binding partners

V Vacic, CJ Oldfield, A Mohan… - Journal of proteome …, 2007 - ACS Publications
Mo lecular R ecognition F eatures (MoRFs) are short, interaction-prone segments of protein
disorder that undergo disorder-to-order transitions upon specific binding, representing a …

Prediction‐based fingerprints of protein–protein interactions

A Porollo, J Meller - Proteins: Structure, Function, and …, 2007 - Wiley Online Library
The recognition of protein interaction sites is an important intermediate step toward
identification of functionally relevant residues and understanding protein function, facilitating …

Dissecting protein–protein recognition sites

P Chakrabarti, J Janin - Proteins: Structure, Function, and …, 2002 - Wiley Online Library
The recognition sites in 70 pairwise protein–protein complexes of known three‐dimensional
structure are dissected in a set of surface patches by clustering atoms at the interface. When …