Fiber statistics of nonwoven materials by SEM images - influence of number of images

Por Götz Andreas, Grabow Niels, Illner Sabine, Senz Volkmar
Publicado em 2021-10-01

Carbon Metabolism of Enterobacterial Human Pathogens Growing in Epithelial Colorectal Adenocarcinoma (Caco-2) Cells

Por Götz, Andreas, Eylert, Eva, Eisenreich, Wolfgang, Goebel, Werner
Publicado em 2010

An extensible interface for QM/MM molecular dynamics simulations with AMBER

Por Götz, Andreas W., Clark, Matthew A., Walker, Ross C.
Publicado em 2013

A Water Dimer Shift Activates a Proton Pumping Pathway in the P(R) → F Transition of ba(3) Cytochrome c Oxidase

Por Du, Wen-Ge Han, Götz, Andreas W., Noodleman, Louis
Publicado no Inorg Chem (2018)

DFT Fe(a3)-O/O-O Vibrational Frequency Calculations over Catalytic Reaction Cycle States in the Dinuclear Center of Cytochrome c Oxidase

Por Han Du, Wen-Ge, Götz, Andreas W., Noodleman, Louis
Publicado no Inorg Chem (2019)

Metabolic Responses of Primary and Transformed Cells to Intracellular Listeria monocytogenes

Por Gillmaier, Nadine, Götz, Andreas, Schulz, Anette, Eisenreich, Wolfgang, Goebel, Werner
Publicado em 2012

Dipeptide Aggregation in Aqueous Solution from Fixed Point-Charge Force Fields

Por Götz, Andreas W., Bucher, Denis, Lindert, Steffen, McCammon, J. Andrew
Publicado em 2014

Cisplatin inhibits MEK1/2

Por Yamamoto, Tetsu, Tsigelny, Igor F., Götz, Andreas W., Howell, Stephen B.
Publicado no Oncotarget (2015)

Low-order many-body interactions determine the local structure of liquid water

Por Riera, Marc, Lambros, Eleftherios, Nguyen, Thuong T., Götz, Andreas W., Paesani, Francesco
Publicado no Chem Sci (2019)

Investigations on physico-chemical properties of TSPCU nonwoven for application as prosthetic venous valve

Por Schubert Julia, Arbeiter Daniela, Götz Andreas, Lebahn Kerstin, Schmidt Wolfram, Grabow Niels, Illner Sabine
Publicado em 2021-10-01

A Broken-Symmetry Density Functional Study of Structures, Energies, and Protonation States along the Catalytic O-O Bond Cleavage Pathway in ba(3) Cytochrome c Oxidase from Thermus...

Por Du, Wen-Ge Han, Götz, Andreas W., Yang, Longhua, Walker, Ross C., Noodleman, Louis
Publicado no Phys Chem Chem Phys (2016)

Electronic Absorption Spectra from MM and ab initio QM/MM Molecular Dynamics: Environmental Effects on the Absorption Spectrum of Photoactive Yellow Protein

Por Isborn, Christine M., Götz, Andreas W., Clark, Matthew A., Walker, Ross C., Martínez, Todd J.
Publicado em 2012

Linking Chemical Electron–Proton Transfer to Proton Pumping in Cytochrome c Oxidase: Broken-Symmetry DFT Exploration of Intermediates along the Catalytic Reaction Pathway of the Ir...

Por Noodleman, Louis, Han Du, Wen-Ge, Fee, James A., Götz, Andreas W., Walker, Ross C.
Publicado em 2014

Routine Microsecond Molecular Dynamics Simulations with AMBER on GPUs. 1. Generalized Born

Por Götz, Andreas W., Williamson, Mark J., Xu, Dong, Poole, Duncan, Le Grand, Scott, Walker, Ross C.
Publicado em 2012

Coupled Transport of Electrons and Protons in a Bacterial Cytochrome c Oxidase—DFT Calculated Properties Compared to Structures and Spectroscopies

Por Noodleman, Louis, Du, Wen-Ge Han, McRee, Duncan, Chen, Ying, Goh, Teffanie, Götz, Andreas W.
Publicado no Phys Chem Chem Phys (2020)

Data for molecular dynamics simulations of B-type cytochrome c oxidase with the Amber force field

Por Yang, Longhua, Skjevik, Åge A., Han Du, Wen-Ge, Noodleman, Louis, Walker, Ross C., Götz, Andreas W.
Publicado no Data Brief (2016)

Water exit pathways and proton pumping mechanism in B-type cytochrome c oxidase from molecular dynamics simulations

Por Yang, Longhua, Skjevik, Åge A., Du, Wen-Ge Han, Noodleman, Louis, Walker, Ross C., Götz, Andreas W.
Publicado no Biochim Biophys Acta (2016)

The adaptive buffered force QM/MM method in the CP2K and AMBER software packages

Por Mones, Letif, Jones, Andrew, Götz, Andreas W, Laino, Teodoro, Walker, Ross C, Leimkuhler, Ben, Csányi, Gábor, Bernstein, Noam
Publicado no J Comput Chem (2015)

A two-stage finite element based method for the study of stiffness and failure load of osteoporotic spines

Por Martin Heiner, Schröder Guido, Schubert Julia, Ringel Anne, Paulsen Jorid, Pfensig Sylvia, Götz Andreas, Schober Hans-Christof, Grabow Niels
Publicado em 2021-10-01