W. Treptow

发表

Structural basis for activation of voltage-gated cation channels.

Letícia Stock, Caio S. Souza, W. Treptow, 2013, Biochemistry.

Environment of the gating charges in the Kv1.2 Shaker potassium channel.

Werner Treptow, Mounir Tarek, M. Tarek, 2006, Biophysical journal.

Conduction in a biological sodium selective channel.

Vincenzo Carnevale, Letícia Stock, Werner Treptow, 2013, The journal of physical chemistry. B.

Folding simulations of a three-dimensional protein model with a nonspecific hydrophobic energy function.

L. G. Garcia, W. Treptow, A. F. D. de Araújo, 2001, Physical review. E, Statistical, nonlinear, and soft matter physics.

Self assembly of peptides near or within membranes using coarse grained MD simulations

B. Maigret, M. Tarek, W. Treptow, 2009 .

Binding of General Anesthetics to Ion Channels

Letícia Stock, W. Treptow, Juliana Hosoume, 2018, bioRxiv.

Double gaps along Shaker S4 demonstrate omega currents at three different closed states

M. Klein, L. Delemotte, M. Tarek, 2010 .

Concentration-dependent thermodynamic analysis of the partition process of small ligands into proteins

Letícia Stock, W. Treptow, Leonardo Cirqueira, 2022, Computational and structural biotechnology journal.

Modeling membranes under a transmembrane potential.

L. Delemotte, M. Tarek, F. Dehez, 2008, The journal of physical chemistry. B.

Coevolutive, evolutive and stochastic information in protein-protein interactions

W. Treptow, Camila Pontes, Miguel Andrade, 2019, bioRxiv.

Positive Allosteric Modulation of Kv Channels by Sevoflurane: Insights into the Structural Basis of Inhaled Anesthetic Action

M. Covarrubias, Caio S. Souza, W. Treptow, 2015, PloS one.

Coupled motions between pore and voltage-sensor domains: a model for Shaker B, a voltage-gated potassium channel.

C. Chipot, B. Maigret, M. Tarek, 2004, Biophysical journal.

The membrane-bound state of K2P potassium channels.

M. Klein, W. Treptow, 2010, Journal of the American Chemical Society.

Intermediate states of the Kv1.2 voltage sensor from atomistic molecular dynamics simulations

Werner Treptow, Lucie Delemotte, Michael L Klein, 2011, Proceedings of the National Academy of Sciences.

Hinge-bending motions in the pore domain of a bacterial voltage-gated sodium channel.

Annika F. Barber, M. Klein, V. Carnevale, 2012, Biochimica et biophysica acta.

Sodium Ion Binding Sites and Hydration in the Lumen of a Bacterial Ion Channel from Molecular Dynamics Simulations

M. Klein, V. Carnevale, W. Treptow, 2011 .

Effect of sensor domain mutations on the properties of voltage-gated ion channels: molecular dynamics studies of the potassium channel Kv1.2.

M. Klein, L. Delemotte, M. Tarek, 2010, Biophysical journal.

Non‐native interactions, effective contact order, and protein folding: A mutational investigation with the energetically frustrated hydrophobic model

M. A. A. Barbosa, L. G. Garcia, W. Treptow, 2002, Proteins.

Initial response of the potassium channel voltage sensor to a transmembrane potential.

M. Klein, M. Tarek, W. Treptow, 2009, Journal of the American Chemical Society.

Exploring conformational states of the bacterial voltage-gated sodium channel NavAb via molecular dynamics simulations

Vincenzo Carnevale, Werner Treptow, Michael L Klein, 2012, Proceedings of the National Academy of Sciences.

Affinity of C60 neat fullerenes with membrane proteins: a computational study on potassium channels.

Werner Treptow, Christophe Ramseyer, Mounir Tarek, 2010, ACS nano.

Donepezil Inhibits Acetylcholinesterase via Multiple Binding Modes at Room Temperature

Werner Treptow, Monica Abreu Silva, Alessandra Sofia Kiametis, 2020, J. Chem. Inf. Model..

Binding of the general anesthetic sevoflurane to ion channels

Letícia Stock, Juliana Hosoume, Leonardo Cirqueira, 2018, PLoS Comput. Biol..

Mechanistic Insights into the Modulation of Voltage-Gated Ion Channels by Inhalational Anesthetics.

Annika F. Barber, R. Eckenhoff, V. Carnevale, 2015, Biophysical journal.

Molecular mapping of general anesthetic sites in a voltage-gated ion channel.

Annika F. Barber, M. Covarrubias, W. Treptow, 2011, Biophysical journal.

Atomistic Model for Simulations of the Sedative Hypnotic Drug 2,2,2-Trichloroethanol

Letícia Stock, W. Treptow, Leonardo Cirqueira, 2018, ACS omega.

Concentration-Dependent Binding of Small Ligands to Multiple Saturable Sites in Membrane Proteins

Letícia Stock, W. Treptow, Juliana Hosoume, 2017, Scientific Reports.

Pore waters regulate ion permeation in a calcium release-activated calcium channel

Vincenzo Carnevale, Werner Treptow, Giacomo Fiorin, 2013, Proceedings of the National Academy of Sciences.

Nucleosome binding peptide presents laudable biophysical and in vivo effects.

C. Grisolia, H. van Ingen, W. Treptow, 2020, Biomedicine & pharmacotherapy = Biomedecine & pharmacotherapie.

Gating motions in voltage-gated potassium channels revealed by coarse-grained molecular dynamics simulations.

Werner Treptow, Mounir Tarek, S. Marrink, 2008, The journal of physical chemistry. B.

Molecular restraints in the permeation pathway of ion channels.

Werner Treptow, Mounir Tarek, M. Tarek, 2006, Biophysical journal.

K+ conduction in the selectivity filter of potassium channels is monitored by the charge distribution along their sequence.

M. Tarek, W. Treptow, 2006, Biophysical journal.

The structure of a new sea anemone toxin: a molecular modeling study of cangitoxin

B. Maigret, M. V. Sousa, W. Treptow, 2003 .

Structural basis for activation of voltage-gated cation channels.

Letícia Stock, Caio S. Souza, W. Treptow, 2013, Biochemistry.

Computer Simulations of Voltage-Gated Cation Channels.

Michael L Klein, Werner Treptow, M. Klein, 2012, The journal of physical chemistry letters.

The binding and mechanism of a positive allosteric modulator of Kv3 channels

W. Treptow, Qiansheng Liang, D. Sauer, 2024, Nature communications.

Biophysical studies of cholesterol effects on chromatin[S]

Caio S. Souza, W. Treptow, Guilherme M. Santos, 2017, Journal of Lipid Research.