Stability of Transmembrane Amyloid β-Peptide and Membrane Integrity Tested by Molecular Modeling of Site-Specific Aβ (42) Mutations

por Poojari, Chetan, Strodel, Birgit
Publicado 2013

Does the inclusion of electronic polarisability lead to a better modelling of peptide aggregation?

por Kav, Batuhan, Strodel, Birgit
Publicado 2022

Topology and parameter data of thirteen non-natural amino acids for molecular simulations with CHARMM22

por Olubiyi, Olujide O., Strodel, Birgit
Publicado 2016

Transition Networks Unveil Disorder-to-Order Transformations in Aβ Caused by Glycosaminoglycans or Lipids

por Schäffler, Moritz, Samantray, Suman, Strodel, Birgit
Publicado 2023

Evaluation of the coarse-grained OPEP force field for protein-protein docking

por Kynast, Philipp, Derreumaux, Philippe, Strodel, Birgit
Publicado 2016

Large-scale, dynamin-like motions of the human guanylate binding protein 1 revealed by multi-resolution simulations

por Barz, Bogdan, Loschwitz, Jennifer, Strodel, Birgit
Publicado 2019

Comparative molecular dynamics simulations of pathogenic and non-pathogenic huntingtin protein monomers and dimers

por Khaled, Mohammed, Strodel, Birgit, Sayyed-Ahmad, Abdallah
Publicado 2023

The Influences of Sulphation, Salt Type, and Salt Concentration on the Structural Heterogeneity of Glycosaminoglycans

por Samantray, Suman, Olubiyi, Olujide O., Strodel, Birgit
Publicado 2021

Development and Application of a Nonbonded Cu(2+) Model That Includes the Jahn–Teller Effect

por Liao, Qinghua, Kamerlin, Shina Caroline Lynn, Strodel, Birgit
Publicado 2015

Rational Drug Design of Peptide-Based Therapies for Sickle Cell Disease

por Olubiyi, Olujide O., Olagunju, Maryam O., Strodel, Birgit
Publicado 2019

Extending the Nonbonded Cationic Dummy Model to Account for Ion-Induced Dipole Interactions

por Liao, Qinghua, Pabis, Anna, Strodel, Birgit, Kamerlin, Shina Caroline Lynn
Publicado 2017

Protein Stability and Unfolding Following Glycine Radical Formation

por Owen, Michael C., Csizmadia, Imre G., Viskolcz, Béla, Strodel, Birgit
Publicado 2017

Thermodynamics and kinetics of the amyloid-β peptide revealed by Markov state models based on MD data in agreement with experiment

por Paul, Arghadwip, Samantray, Suman, Anteghini, Marco, Khaled, Mohammed, Strodel, Birgit
Publicado 2021

Structural features determining thermal adaptation of esterases

por Kovacic, Filip, Mandrysch, Agathe, Poojari, Chetan, Strodel, Birgit, Jaeger, Karl-Erich
Publicado 2016

Interference with Amyloid-β Nucleation by Transient Ligand Interaction

por Zhang, Tao, Loschwitz, Jennifer, Strodel, Birgit, Nagel-Steger, Luitgard, Willbold, Dieter
Publicado 2019

Computer simulations of protein–membrane systems

por Loschwitz, Jennifer, Olubiyi, Olujide O., Hub, Jochen S., Strodel, Birgit, Poojari, Chetan S.
Publicado 2020

High Throughput Virtual Screening to Discover Inhibitors of the Main Protease of the Coronavirus SARS-CoV-2

por Olubiyi, Olujide O., Olagunju, Maryam, Keutmann, Monika, Loschwitz, Jennifer, Strodel, Birgit
Publicado 2020

Molecular modeling of human alkaline sphingomyelinase

por Suresh, Panneer Selvam, Olubiyi, Olujide, Thirunavukkarasu, Chinnasamy, Strodel, Birgit, Kumar, Muthuvel Suresh
Publicado 2011

Shuffling Active Site Substate Populations Affects Catalytic Activity: The Case of Glucose Oxidase

por Petrović, Dušan, Frank, David, Kamerlin, Shina Caroline Lynn, Hoffmann, Kurt, Strodel, Birgit
Publicado 2017

Amyloid-β peptide dimers undergo a random coil to β-sheet transition in the aqueous phase but not at the neuronal membrane

por Fatafta, Hebah, Khaled, Mohammed, Owen, Michael C., Sayyed-Ahmad, Abdallah, Strodel, Birgit
Publicado 2021