Lista de obras - Günther H Peters - Dominio Público Uruguay

A Theoretical Study of the Separation Principle in Size Exclusion Chromatography

A novel strategy for the development of selective active-site inhibitors of the protein tyrosine phosphatase-like proteins islet-cell antigen 512 (IA-2) and phogrin (IA-2beta).

artículo científico publicado en 2003

Active serine involved in the stabilization of the active site loop in the Humicola lanuginosa lipase

artículo científico publicado en 1998

Advancing Therapeutic Protein Discovery and Development through Comprehensive Computational and Biophysical Characterization

scientific article published on 07 January 2020

Affinity of four polar neurotransmitters for lipid bilayer membranes.

artículo científico publicado en 2010

Ammonium recruitment and ammonia transport by E. coli ammonia channel AmtB

artículo científico publicado en 2006

Binding of serotonin to lipid membranes.

artículo científico publicado en 2013

Chemoenzymatic synthesis of fluorogenic phospholipids and evaluation in assays of phospholipases A, C and D.

artículo científico publicado en 2016

Computational analysis of chain flexibility and fluctuations in Rhizomucor miehei lipase.

artículo científico publicado en 1999

Computational investigation of enthalpy-entropy compensation in complexation of glycoconjugated bile salts with β-cyclodextrin and analogs.

artículo científico publicado en 2014

Computational studies of the activation of lipases and the effect of a hydrophobic environment

artículo científico publicado en 1997

Computer simulation of the rheology of grafted chains under shear

scientific article published on 01 August 1995

Computer simulation of the rheology of grafted chains under shear. II. Depletion of chains at the wall

artículo científico publicado en 1996

Computing Cellulase Kinetics with a Two-Domain Linear Interaction Energy Approach

artículo científico publicado en 2021

Concentrated protein solutions investigated using acoustic levitation and small-angle X-ray scattering

artículo científico publicado en 2020

Conformational Stability Study of a Therapeutic Peptide Plectasin Using Molecular Dynamics Simulations in Combination with NMR

scientific article published on 31 May 2019

Correlated volume-energy fluctuations of phospholipid membranes: a simulation study

artículo científico publicado en 2010

Crystal Structure of Glucagon-like Peptide-1 in Complex with the Extracellular Domain of the Glucagon-like Peptide-1 Receptor

artículo científico publicado en 2010

Determination of stability constants of tauro- and glyco-conjugated bile salts with the negatively charged sulfobutylether-β-cyclodextrin: comparison of affinity capillary electrophoresis and isothermal titration calorimetry and thermodynamic analys

Development of a cysteine-deprived and C-terminally truncated GLP-1 receptor.

artículo científico publicado en 2013

Diffusion of water and selected atoms in DMPC lipid bilayer membranes.

artículo científico publicado en 2012

Dipolar and chain-linking effects on the rheology of grafted chains in a nanopore under shear at different grafting densities

artículo científico publicado en 2001

Domain-induced activation of human phospholipase A2 type IIA: local versus global lipid composition.

artículo científico publicado en 2006

Drug delivery by an enzyme-mediated cyclization of a lipid prodrug with unique bilayer-formation properties

artículo científico publicado en 2009

Dual Nicotinic Acetylcholine Receptors α4β2 Antagonists/α7 Agonists: Synthesis, Docking Studies and Pharmacological Evaluation of Tetrahydroisoquinolines and Tetrahydroisoquinolinium Salts.

artículo científico publicado en 2018

Electrostatic evaluation of the signature motif (H/V)CX5R(S/T) in protein-tyrosine phosphatases.

artículo científico publicado en 1998

Equilibrium partitioning of macromolecules in confining geometries: improved universality with a new molecular size parameter

artículo científico publicado en 2008

Essential dynamics of lipase binding sites: the effect of inhibitors of different chain length

scientific article published on 01 February 1997

Essential motions in a fungal lipase with bound substrate, covalently attached inhibitor and product.

artículo científico publicado en 2002

Evaluation of a concerted vs. sequential oxygen activation mechanism in α-ketoglutarate-dependent nonheme ferrous enzymes

artículo científico publicado en 2020

Exploring the local elastic properties of bilayer membranes using molecular dynamics simulations

artículo científico publicado en 2014

Glucagon-like Peptide 1 Conjugated to Recombinant Human Serum Albumin Variants with Modified Neonatal Fc Receptor Binding Properties. Impact on Molecular Structure and Half-Life

artículo científico publicado en 2017

Homology modeling of the serotonin transporter: insights into the primary escitalopram-binding site.

artículo científico publicado en 2007

In silico study of amphiphilic nanotubes based on cyclic peptides in polar and non-polar solvent

artículo científico publicado en 2016

Influence of a Lipid Interface on Protein Dynamics in a Fungal Lipase ⬇️

artículo científico publicado el 1 de diciembre de 2001

Interaction of neurotransmitters with a phospholipid bilayer: a molecular dynamics study

artículo científico publicado en 2014

Investigations of Albumin-Insulin Detemir Complexes Using Molecular Dynamics Simulations and Free Energy Calculations

scientific article published on 16 December 2019

Isoform-Specific Substrate Inhibition Mechanism of Human Tryptophan Hydroxylase

artículo científico publicado en 2017

Mean Span Dimensions of Ideal Polymer Chains Containing Branches and Rings

Mechanistic study of the sPLA2-mediated hydrolysis of a thio-ester pro anticancer ether lipid.

artículo científico publicado en 2009

Membrane Interaction of the Factor VIIIa Discoidin Domains in Atomistic Detail

artículo científico publicado en 2015

Membrane restructuring by phospholipase A2 is regulated by the presence of lipid domains

artículo científico publicado en 2011

Methodological problems in pressure profile calculations for lipid bilayers

scientific article published on 01 March 2005

Methyl 1-ethyl-3'-[hy-droxy(naphthalen-1-yl)meth-yl]-1'-methyl-2-oxo-spiro-[indo-line-3,2'-pyrrolidine]-3'-carboxyl-ate

artículo científico publicado en 2014

Molecular dynamics simulations of Na+/Cl(-)-dependent neurotransmitter transporters in a membrane-aqueous system

scientific article published on 01 June 2007

Molecular packing in 1-hexanol-DMPC bilayers studied by molecular dynamics simulation

artículo científico publicado en 2006

Oligomerization of a Glucagon-like Peptide 1 Analog: Bridging Experiment and Simulations

artículo científico publicado en 2015

Pair correlation function integrals: computation and use.

artículo científico publicado en 2011

Proof of the identity between the depletion layer thickness and half the average span for an arbitrary polymer chain

artículo científico publicado en 2008

Protein dynamics in organic media at varying water activity studied by molecular dynamics simulation

article

Reconciliation of opposing views on membrane-sugar interactions

artículo científico publicado en 2011

Reparameterization of all-atom dipalmitoylphosphatidylcholine lipid parameters enables simulation of fluid bilayers at zero tension.

artículo científico publicado en 2007

Residue 182 influences the second step of protein-tyrosine phosphatase-mediated catalysis.

artículo científico publicado en 2004

Residue 259 in protein-tyrosine phosphatase PTP1B and PTPalpha determines the flexibility of glutamine 262.

artículo científico publicado en 2004

Residue 259 is a key determinant of substrate specificity of protein-tyrosine phosphatases 1B and alpha

artículo científico publicado en 2000

Secretory phospholipase A2 activity toward diverse substrates.

artículo científico publicado en 2011

Secretory phospholipase A2 hydrolysis of phospholipid analogues is dependent on water accessibility to the active site

artículo científico publicado en 2007

Self-Interaction of Human Serum Albumin: A Formulation Perspective

artículo científico publicado en 2018

Simulation of the coupling between nucleotide binding and transmembrane domains in the ATP binding cassette transporter BtuCD.

artículo científico publicado en 2007

Simulations of a membrane-anchored peptide: structure, dynamics, and influence on bilayer properties.

artículo científico publicado en 2004

Soluble 1:1 complexes and insoluble 3:2 complexes - Understanding the phase-solubility diagram of hydrocortisone and γ-cyclodextrin.

artículo científico publicado en 2017

Solution structures of long-acting insulin analogues and their complexes with albumin

scientific article published on 26 February 2019

Stabilization of tryptophan hydroxylase 2 by l-phenylalanine-induced dimerization.

artículo científico publicado en 2016

Steric Hindrance as a Basis for Structure-Based Design of Selective Inhibitors of Protein-Tyrosine Phosphatases ⬇️

artículo científico publicado el 11 de diciembre de 2001

Structural and functional aspects of mannuronic acid-specific PL6 alginate lyase from the human gut microbe Bacteroides cellulosilyticus

artículo científico publicado en 2019

Structure and dynamics of lipid monolayers: implications for enzyme catalysed lipolysis

scientific article published on 01 May 1995

Structure and dynamics of water and lipid molecules in charged anionic DMPG lipid bilayer membranes

artículo científico publicado en 2016

Structure-based design of a low molecular weight, nonphosphorus, nonpeptide, and highly selective inhibitor of protein-tyrosine phosphatase 1B

artículo científico publicado en 2000

Substrate recognition in the Escherichia coli ammonia channel AmtB: a QM/MM investigation.

artículo científico publicado en 2010

Synthesis and serotonin transporter activity of 1,3-bis(aryl)-2-nitro-1-propenes as a new class of anticancer agents.

artículo científico publicado en 2010

Synthesis and serotonin transporter activity of sulphur-substituted alpha-alkyl phenethylamines as a new class of anticancer agents

artículo científico publicado en 2009

Synthesis of sn-1 functionalized phospholipids as substrates for secretory phospholipase A2

artículo científico publicado en 2007

The Importance of Magnesium in the Human Body: A Systematic Literature Review.

artículo científico publicado en 2016

The effect of Asp54 phosphorylation on the energetics and dynamics in the response regulator protein Spo0F studied by molecular dynamics

artículo científico publicado en 2009

The effect of calcium on the properties of charged phospholipid bilayers

scientific article published on 19 April 2006

The hydrophobic effect: molecular dynamics simulations of water confined between extended hydrophobic and hydrophilic surfaces

artículo científico publicado en 2004

The influence of different linker modifications on the catalytic activity and cellulose affinity of cellobiohydrolase Cel7A from Hypocrea jecorina.

artículo científico publicado en 2017

Theoretical Assessment of Fluorinated Phospholipids in the Design of Liposomal Drug-Delivery Systems

artículo científico publicado en 2016

Transmembrane α-Helix 2 and 7 Are Important for Small Molecule-Mediated Activation of the GLP-1 Receptor

artículo científico publicado en 2011

Water Distribution and Clustering on the Lyophilized IgG1 Surface: Insight from Molecular Dynamics Simulations

scientific article published on 11 February 2020

Water in contact with extended hydrophobic surfaces: direct evidence of weak dewetting

artículo científico publicado en 2003

Water-Intake and Water-Molecule Paths to the Active Site of Secretory Phospholipase A2 Studied Using MD Simulations and the Tracking Tool AQUA-DUCT

scientific article published on 03 March 2020

Lista de obras de Günther H Peters

A Theoretical Study of the Separation Principle in Size Exclusion Chromatography

A novel strategy for the development of selective active-site inhibitors of the protein tyrosine phosphatase-like proteins islet-cell antigen 512 (IA-2) and phogrin (IA-2beta).

Active serine involved in the stabilization of the active site loop in the Humicola lanuginosa lipase

Advancing Therapeutic Protein Discovery and Development through Comprehensive Computational and Biophysical Characterization

Affinity of four polar neurotransmitters for lipid bilayer membranes.

Ammonium recruitment and ammonia transport by E. coli ammonia channel AmtB

Binding of serotonin to lipid membranes.

Chemoenzymatic synthesis of fluorogenic phospholipids and evaluation in assays of phospholipases A, C and D.

Computational analysis of chain flexibility and fluctuations in Rhizomucor miehei lipase.

Computational investigation of enthalpy-entropy compensation in complexation of glycoconjugated bile salts with β-cyclodextrin and analogs.

Computational studies of the activation of lipases and the effect of a hydrophobic environment

Computer simulation of the rheology of grafted chains under shear

Computer simulation of the rheology of grafted chains under shear. II. Depletion of chains at the wall

Computing Cellulase Kinetics with a Two-Domain Linear Interaction Energy Approach

Concentrated protein solutions investigated using acoustic levitation and small-angle X-ray scattering

Conformational Stability Study of a Therapeutic Peptide Plectasin Using Molecular Dynamics Simulations in Combination with NMR

Correlated volume-energy fluctuations of phospholipid membranes: a simulation study

Crystal Structure of Glucagon-like Peptide-1 in Complex with the Extracellular Domain of the Glucagon-like Peptide-1 Receptor

Determination of stability constants of tauro- and glyco-conjugated bile salts with the negatively charged sulfobutylether-β-cyclodextrin: comparison of affinity capillary electrophoresis and isothermal titration calorimetry and thermodynamic analys

Development of a cysteine-deprived and C-terminally truncated GLP-1 receptor.

Diffusion of water and selected atoms in DMPC lipid bilayer membranes.

Dipolar and chain-linking effects on the rheology of grafted chains in a nanopore under shear at different grafting densities

Domain-induced activation of human phospholipase A2 type IIA: local versus global lipid composition.

Drug delivery by an enzyme-mediated cyclization of a lipid prodrug with unique bilayer-formation properties

Dual Nicotinic Acetylcholine Receptors α4β2 Antagonists/α7 Agonists: Synthesis, Docking Studies and Pharmacological Evaluation of Tetrahydroisoquinolines and Tetrahydroisoquinolinium Salts.

Electrostatic evaluation of the signature motif (H/V)CX5R(S/T) in protein-tyrosine phosphatases.

Equilibrium partitioning of macromolecules in confining geometries: improved universality with a new molecular size parameter

Essential dynamics of lipase binding sites: the effect of inhibitors of different chain length

Essential motions in a fungal lipase with bound substrate, covalently attached inhibitor and product.

Evaluation of a concerted vs. sequential oxygen activation mechanism in α-ketoglutarate-dependent nonheme ferrous enzymes

Exploring the local elastic properties of bilayer membranes using molecular dynamics simulations

Glucagon-like Peptide 1 Conjugated to Recombinant Human Serum Albumin Variants with Modified Neonatal Fc Receptor Binding Properties. Impact on Molecular Structure and Half-Life

Homology modeling of the serotonin transporter: insights into the primary escitalopram-binding site.

In silico study of amphiphilic nanotubes based on cyclic peptides in polar and non-polar solvent

Influence of a Lipid Interface on Protein Dynamics in a Fungal Lipase ⬇️

Interaction of neurotransmitters with a phospholipid bilayer: a molecular dynamics study

Investigations of Albumin-Insulin Detemir Complexes Using Molecular Dynamics Simulations and Free Energy Calculations

Isoform-Specific Substrate Inhibition Mechanism of Human Tryptophan Hydroxylase

Mean Span Dimensions of Ideal Polymer Chains Containing Branches and Rings

Mechanistic study of the sPLA2-mediated hydrolysis of a thio-ester pro anticancer ether lipid.

Membrane Interaction of the Factor VIIIa Discoidin Domains in Atomistic Detail

Membrane restructuring by phospholipase A2 is regulated by the presence of lipid domains

Methodological problems in pressure profile calculations for lipid bilayers

Methyl 1-ethyl-3'-[hy-droxy(naphthalen-1-yl)meth-yl]-1'-methyl-2-oxo-spiro-[indo-line-3,2'-pyrrolidine]-3'-carboxyl-ate

Molecular dynamics simulations of Na+/Cl(-)-dependent neurotransmitter transporters in a membrane-aqueous system

Molecular packing in 1-hexanol-DMPC bilayers studied by molecular dynamics simulation

Oligomerization of a Glucagon-like Peptide 1 Analog: Bridging Experiment and Simulations

Pair correlation function integrals: computation and use.

Proof of the identity between the depletion layer thickness and half the average span for an arbitrary polymer chain

Protein dynamics in organic media at varying water activity studied by molecular dynamics simulation

Reconciliation of opposing views on membrane-sugar interactions

Reparameterization of all-atom dipalmitoylphosphatidylcholine lipid parameters enables simulation of fluid bilayers at zero tension.

Residue 182 influences the second step of protein-tyrosine phosphatase-mediated catalysis.

Residue 259 in protein-tyrosine phosphatase PTP1B and PTPalpha determines the flexibility of glutamine 262.

Residue 259 is a key determinant of substrate specificity of protein-tyrosine phosphatases 1B and alpha

Secretory phospholipase A2 activity toward diverse substrates.

Secretory phospholipase A2 hydrolysis of phospholipid analogues is dependent on water accessibility to the active site

Self-Interaction of Human Serum Albumin: A Formulation Perspective

Simulation of the coupling between nucleotide binding and transmembrane domains in the ATP binding cassette transporter BtuCD.

Simulations of a membrane-anchored peptide: structure, dynamics, and influence on bilayer properties.

Soluble 1:1 complexes and insoluble 3:2 complexes - Understanding the phase-solubility diagram of hydrocortisone and γ-cyclodextrin.

Solution structures of long-acting insulin analogues and their complexes with albumin

Stabilization of tryptophan hydroxylase 2 by l-phenylalanine-induced dimerization.

Steric Hindrance as a Basis for Structure-Based Design of Selective Inhibitors of Protein-Tyrosine Phosphatases ⬇️

Structural and functional aspects of mannuronic acid-specific PL6 alginate lyase from the human gut microbe Bacteroides cellulosilyticus

Structure and dynamics of lipid monolayers: implications for enzyme catalysed lipolysis

Structure and dynamics of water and lipid molecules in charged anionic DMPG lipid bilayer membranes

Structure-based design of a low molecular weight, nonphosphorus, nonpeptide, and highly selective inhibitor of protein-tyrosine phosphatase 1B

Substrate recognition in the Escherichia coli ammonia channel AmtB: a QM/MM investigation.

Synthesis and serotonin transporter activity of 1,3-bis(aryl)-2-nitro-1-propenes as a new class of anticancer agents.

Synthesis and serotonin transporter activity of sulphur-substituted alpha-alkyl phenethylamines as a new class of anticancer agents

Synthesis of sn-1 functionalized phospholipids as substrates for secretory phospholipase A2

The Importance of Magnesium in the Human Body: A Systematic Literature Review.

The effect of Asp54 phosphorylation on the energetics and dynamics in the response regulator protein Spo0F studied by molecular dynamics

The effect of calcium on the properties of charged phospholipid bilayers

The hydrophobic effect: molecular dynamics simulations of water confined between extended hydrophobic and hydrophilic surfaces

The influence of different linker modifications on the catalytic activity and cellulose affinity of cellobiohydrolase Cel7A from Hypocrea jecorina.

Theoretical Assessment of Fluorinated Phospholipids in the Design of Liposomal Drug-Delivery Systems

Transmembrane α-Helix 2 and 7 Are Important for Small Molecule-Mediated Activation of the GLP-1 Receptor