Mechanistic understanding from molecular dynamics in pharmaceutical research 2: lipid membrane in drug design

T Róg, M Girych, A Bunker - Pharmaceuticals, 2021 - mdpi.com
We review the use of molecular dynamics (MD) simulation as a drug design tool in the
context of the role that the lipid membrane can play in drug action, ie, the interaction …

Toward manipulating serotonin signaling via the microbiota–gut–brain axis

BA Everett, P Tran, A Prindle - Current Opinion in Biotechnology, 2022 - Elsevier
Highlights•Serotonin can interact with bacterial proteins with a range of effects.•Serotonin is
used in signaling between members of the microbiome and host.•Microbiome dysbiosis is …

Phospholipid membranes as chemically and functionally tunable materials

D Huster, S Maiti, A Herrmann - Advanced Materials, 2024 - Wiley Online Library
The sheet‐like lipid bilayer is the fundamental structural component of all cell membranes.
Its building blocks are phospholipids and cholesterol. Their amphiphilic structure …

Atomic force microscopy and other scanning probe microscopy methods to study nanoscale domains in model lipid membranes

M Robinson, CT Filice, DM McRae… - Advances in Physics …, 2023 - Taylor & Francis
The cell membrane is a fundamental biological structure, which is only 6–10 nm thick. It is
composed of hundreds of lipid types, which form small and dynamic lipid domains or rafts …

Serotonergic drugs modulate the phase behavior of complex lipid bilayers

G Musabirova, O Engberg, A Gupta, DS Roy, S Maiti… - Biochimie, 2022 - Elsevier
Serotonin is an endogenous neurotransmitter involved in both physiological and
pathophysiological processes. Traditionally, serotonin acts as a ligand for G protein-coupled …

Membrane-Mediated Allosteric Action of Serotonin on a Noncognate G-Protein-Coupled Receptor

DS Roy, M Gozzi, O Engberg, J Adler… - The Journal of …, 2024 - ACS Publications
The structure and dynamics of the lipid membrane can affect the activity of membrane
proteins. Therefore, small lipophilic molecules that alter membrane properties (such as the …

Selective advantages of synapses in evolution

LL Moroz, DY Romanova - Frontiers in Cell and Developmental …, 2021 - frontiersin.org
The common ancestor of all Metazoa (Urmetazoan) was a nerveless animal (Mackie, 1970,
1990; Moroz, 2009). This hypothetical Urmetazoan likely used electrical and chemical …

Unusual Robustness of Neurotransmitter Vesicle Membranes against Serotonin-Induced Perturbations

A Gupta, P Krupa, O Engberg, M Krupa… - The Journal of …, 2023 - ACS Publications
Nature confines hundreds of millimolar of amphiphilic neurotransmitters, such as serotonin,
in synaptic vesicles. This appears to be a puzzle, as the mechanical properties of lipid …

Different membrane order measurement techniques are not mutually consistent

A Gupta, M Kallianpur, DS Roy, O Engberg… - Biophysical …, 2023 - cell.com
Abstract" Membrane order" is a term commonly used to describe the elastic and mechanical
properties of the lipid bilayer, though its exact meaning is somewhat context-and method …

Structural details on the interaction of fenamates with lipid membranes

IA Khodov, GS Musabirova, VV Klochkov… - Journal of Molecular …, 2022 - Elsevier
Fenamates are nonsteroidal anti-inflammatory drugs (NSAID), usually prescribed to treat
pain and inflammation and, like other NSAIDs, to inhibit cyclooxygenases. They have also …