Cargando…

Analysis of the Equilibrium Distribution of Ligands in Heterogeneous Media–Approaches and Pitfalls

The equilibrium distribution of small molecules (ligands) between binding agents in heterogeneous media is an important property that determines their activity. Heterogeneous systems containing proteins and lipid membranes are particularly relevant due to their prevalence in biological systems, and...

Descripción completa

Detalles Bibliográficos
Autores principales:	Moreno, Maria João, Loura, Luís M. S., Martins, Jorge, Salvador, Armindo, Velazquez-Campoy, Adrian
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	MDPI 2022
Materias:	Review
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9478965/ https://www.ncbi.nlm.nih.gov/pubmed/36077155 http://dx.doi.org/10.3390/ijms23179757

Ejemplares similares

Ligand’s Partition to the Lipid Bilayer Should Be Accounted for When Estimating Their Affinity to Proteins
por: Moreno, Maria João, et al.
Publicado: (2023)

Thermal non-equilibrium in heterogeneous media
por: de Lemos, Marcelo J S
Publicado: (2016)

Modeling Gd(3+) Complexes for Molecular Dynamics Simulations: Toward a Rational Optimization of MRI Contrast Agents
por: Oliveira, Alexandre C., et al.
Publicado: (2022)

Spatial distributions at equilibrium under heterogeneous transient subdiffusion
por: Berry, Hugues, et al.
Publicado: (2014)

Simple Estimation of Förster Resonance Energy Transfer (FRET) Orientation Factor Distribution in Membranes
por: Loura, Luís M. S.
Publicado: (2012)

Kinetics and thermodynamics of the protein-ligand interactions in the riboflavin kinase activity of the FAD synthetase from Corynebacterium ammoniagenes
por: Sebastián, María, et al.
Publicado: (2017)

Calculation of Permeability Coefficients from Solute Equilibration Dynamics: An Assessment of Various Methods
por: Cordeiro, Margarida M., et al.
Publicado: (2022)

Fundraising and vote distribution: A non-equilibrium statistical approach
por: Melo, Hygor P. M., et al.
Publicado: (2019)

Structural identifiability of equilibrium ligand-binding parameters
por: Middendorf, Thomas R., et al.
Publicado: (2017)

Lateral Distribution of NBD-PC Fluorescent Lipid Analogs in Membranes Probed by Molecular Dynamics-Assisted Analysis of Förster Resonance Energy Transfer (FRET) and Fluorescence Quenching
por: Loura, Luís M. S.
Publicado: (2012)

Possibilities and Pitfalls of Social Media for Translational Medicine
por: Dijkstra, Suzan, et al.
Publicado: (2018)

Accurate absolute free energies for ligand–protein binding based on non-equilibrium approaches
por: Gapsys, Vytautas, et al.
Publicado: (2021)

Avoiding Pitfalls in the Statistical Analysis of Heterogeneous Tumors
por: Axelrod, David E., et al.
Publicado: (2009)

Epidemic Spreading and Equilibrium Social Distancing in Heterogeneous Networks
por: Amini, Hamed, et al.
Publicado: (2022)

Equilibrium Beam Distribution and Halo in the LHC
por: Assmann, R W, et al.
Publicado: (2002)

The Secret Lives of Fluorescent Membrane Probes as Revealed by Molecular Dynamics Simulations
por: Filipe, Hugo A. L., et al.
Publicado: (2020)

Permeation of a Homologous Series of NBD-Labeled Fatty Amines through Lipid Bilayers: A Molecular Dynamics Study
por: Filipe, Hugo A. L., et al.
Publicado: (2023)

Dynamic equilibrium of heterogeneous and interconvertible multipotent hematopoietic cell subsets
por: Weston, Wendy, et al.
Publicado: (2014)

In Silico Veritas: The Pitfalls and Challenges of Predicting GPCR-Ligand Interactions
por: Roumen, Luc, et al.
Publicado: (2011)

Equilibrium of Global Amphibian Species Distributions with Climate
por: Munguía, Mariana, et al.
Publicado: (2012)

On the Distribution of the Wave Function for Systems in Thermal Equilibrium
por: Goldstein, S, et al.
Publicado: (2005)

Transition in the Equilibrium Distribution Function of Relativistic Particles
por: Mendoza, M., et al.
Publicado: (2012)

Rational stabilization of complex proteins: a divide and combine approach
por: Lamazares, Emilio, et al.
Publicado: (2015)

Towards Social Media as DTx in Psychiatry? Current opportunities and pitfalls
por: Orsolini, L.
Publicado: (2023)

Glucose-6-Phosphate Dehydrogenase Deficiency and Neonatal Hyperbilirubinemia: Insights on Pathophysiology, Diagnosis, and Gene Variants in Disease Heterogeneity
por: Lee, Heng Yang, et al.
Publicado: (2022)

The structure of binding curves and practical identifiability of equilibrium ligand-binding parameters
por: Middendorf, Thomas R., et al.
Publicado: (2017)

Calculating the mean time to capture for tethered ligands and its effect on the chemical equilibrium of bound ligand pairs
por: Shen, Lu, et al.
Publicado: (2016)

Macroeconomic and distributional impacts of exchange rate devaluation in Ethiopia: A computable general equilibrium approach
por: Woldie, Getachew A., et al.
Publicado: (2019)

Merits and Pitfalls of Social Media as a Platform for Recruitment of Study Participants
por: Oudat, Qutaibah, et al.
Publicado: (2023)

Equilibrium distributions of simple biochemical reaction systems for time-scale separation in stochastic reaction networks
por: Mélykúti, Bence, et al.
Publicado: (2014)

Critical dynamics: a field theory approach to equilibrium and non-equilibrium scaling behavior
por: Täuber, Uwe C
Publicado: (2014)

Stochastic approaches to out-of-equilibrium dynamics
por: Chomaz, P
Publicado: (1997)

Equilibrium and non‐equilibrium dynamics simultaneously operate in the Galápagos islands
por: Valente, Luis M., et al.
Publicado: (2015)

The surprising difficulty of “simple” equilibrium binding measurements on ligand-gated ion channels
por: Middendorf, Thomas R., et al.
Publicado: (2022)

Promise and pitfalls of the Immunochip
por: Cortes, Adrian, et al.
Publicado: (2011)

Comparing Distributions of Color Words: Pitfalls and Metric Choices
por: Vejdemo-Johansson, Mikael, et al.
Publicado: (2014)

Efficient calculation of heterogeneous non-equilibrium statistics in coupled firing-rate models
por: Ly, Cheng, et al.
Publicado: (2019)

A Ridesharing Choice Behavioral Equilibrium Model with Users of Heterogeneous Values of Time
por: Li, Xingyuan, et al.
Publicado: (2021)

Capsule Endoscopy: Pitfalls and Approaches to Overcome
por: Kim, Seung Han, et al.
Publicado: (2021)

From Physics to Biology: the interface between experiment and computation
por: Clemente-Gallardo, J, et al.
Publicado: (2006)

Cannot write session to /tmp/vufind_sessions/sess_99mu85uqnph4ol1h9u03spfjnl