Search Results - "Maurer, Patrick"

Generalized QM/MM Force Matching Approach Applied to the 11-cis Protonated Schiff Base Chromophore of Rhodopsin by Doemer, Manuel, Maurer, Patrick, Campomanes, Pablo, Tavernelli, Ivano, Rothlisberger, Ursula

“…We extended a previously developed force matching approach to systems with covalent QM/MM boundaries and describe its user-friendly implementation in the…”
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Transfer of penicillin resistance from Streptococcus oralis to Streptococcus pneumoniae identifies murE as resistance determinant by Todorova, Katya, Maurer, Patrick, Rieger, Martin, Becker, Tina, Bui, Nhat Khai, Gray, Joe, Vollmer, Waldemar, Hakenbeck, Regine

“…Summary Beta‐lactam resistant clinical isolates of Streptococcus pneumoniae contain altered penicillin‐binding protein (PBP) genes and occasionally an altered…”
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The genome of Streptococcus mitis B6--what is a commensal? by Denapaite, Dalia, Brückner, Reinhold, Nuhn, Michael, Reichmann, Peter, Henrich, Bernhard, Maurer, Patrick, Schähle, Yvonne, Selbmann, Peter, Zimmermann, Wolfgang, Wambutt, Rolf, Hakenbeck, Regine

“…Streptococcus mitis is the closest relative of the major human pathogen S. pneumoniae. The 2,15 Mb sequence of the Streptococcus mitis B6 chromosome, an…”
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Altered lipid composition in Streptococcus pneumoniae cpoA mutants by Meiers, Marina, Volz, Carsten, Eisel, Jessica, Maurer, Patrick, Henrich, Bernhard, Hakenbeck, Regine

“…Penicillin-resistance in Streptococcus pneumoniae is mainly due to alterations in genes encoding the target enzymes for beta-lactams, the penicillin-binding…”
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The Pneumococcal Cell Envelope Stress-Sensing System LiaFSR Is Activated by Murein Hydrolases and Lipid II-Interacting Antibiotics by ELDHOLM, Vegard, GUTT, Beatrice, JOHNSBORG, Ola, BRÜCKNER, Reinhold, MAURER, Patrick, HAKENBECK, Regine, MASCHER, Thorsten, HAVARSTEIN, Leiv Sigve

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Genome of Streptococcus oralis Strain Uo5 by Reichmann, Peter, Nuhn, Michael, Denapaite, Dalia, Brückner, Reinhold, Henrich, Bernhard, Maurer, Patrick, Rieger, Martin, Klages, Sven, Reinhard, Richard, Hakenbeck, Regine

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Parameterization of azole-bridged dinuclear platinum anticancer drugs via a QM/MM force matching procedure by Spiegel, Katrin, Magistrato, Alessandra, Maurer, Patrick, Ruggerone, Paolo, Rothlisberger, Ursula, Carloni, Paolo, Reedijk, Jan, Klein, Michael L

“…Azole-bridged diplatinum compounds are promising new anticancer drugs designed to induce small distortions upon DNA alkylation, able to circumvent resistance…”
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Nup2p, a Yeast Nucleoporin, Functions in Bidirectional Transport of Importin α by Solsbacher, Jens, Maurer, Patrick, Vogel, Frank, Schlenstedt, Gabriel

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Cavity-Based 3D Cooling of a Levitated Nanoparticle via Coherent Scattering by Windey, Dominik, Gonzalez-Ballestero, Carlos, Maurer, Patrick, Novotny, Lukas, Romero-Isart, Oriol, Reimann, René

“…We experimentally realize cavity cooling of all three translational degrees of motion of a levitated nanoparticle in vacuum. The particle is trapped by a…”
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Cse1p Is Involved in Export of Yeast Importin α from the Nucleus by Solsbacher, Jens, Maurer, Patrick, Bischoff, F. Ralf, Schlenstedt, Gabriel

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Peroxynitrite does not decompose to singlet oxygen (1delta gO2) and nitroxyl (NO-) by Martinez, G.R, Mascio, P. Di, Bonini, M.G, Augusto, O, Briviba, K, Sies, H, Maurer, P, R÷thlisberger, U, Herold, S, Koppenol, W.H

“…According to Khan et al. [Khan, A. U., Kovacic, D., Kolbanovskiy, A., Desai, M., Frenkel, K. & Geacintov, N. E. (2000) Proc. Natl. Acad. Sci. USA 97,…”
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Interaction between an Optically Levitated Nanoparticle and Its Thermal Image: Internal Thermometry via Displacement Sensing by Agrenius, Thomas, Gonzalez-Ballestero, Carlos, Maurer, Patrick, Romero-Isart, Oriol

“…We propose and theoretically analyze an experiment where displacement sensing of an optically levitated nanoparticle in front of a surface can be used to…”
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Chronic lymphocytic leukaemia: clinical-aetiological findings in 66 patients and their families by Weber, Walter, Maurer, Patrick F, Estoppey, Jacqueline, Zwahlen, Marcel

“…Little is known about the aetiology of chronic lymphocytic leukaemia (CLL). The family medical history is a "genomic tool" capturing interactions of genetic…”
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Levitated Optomechanics with Meta-Atoms by Lepeshov, Sergei, Meyer, Nadine, Maurer, Patrick, Romero-Isart, Oriol, Quidant, Romain

“…We propose to introduce additional control in levitated optomechanics by trapping a meta-atom, i.e., a subwavelength and high-permittivity dielectric particle…”
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Molecular mechanisms of β-lactam resistance in Streptococcus pneumoniae by Hakenbeck, Regine, Brückner, Reinhold, Denapaite, Dalia, Maurer, Patrick

“…Alterations in the target enzymes for β-lactam antibiotics, the penicillin-binding proteins (PBPs), have been recognized as a major resistance mechanism in…”
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Hybrid QM/MM Car-Parrinello Simulations of Catalytic and Enzymatic Reactions by Maria Carola Colombo, Martin Zumstein, Joost VandeVondele, Marialore Sulpizi, Katrin Spiegel, Ute Röhrig, Stefano Piana, Patrick Maurer, Alessandra Magistrato, Alessandro Laio, Leonardo Guidoni, Ursula Röthlisberger

“…First-principles molecular dynamics (Car-Parrinello) simulations based on density functional theory have emerged as a powerful tool for the study of physical,…”
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Expression of hypoxia-inducible genes in tumor cells by KRESS, S, STEIN, A, MAURER, P, WEBER, B, REICHERT, J, BUCHMANN, A, HUPPERT, P, SCHWARZ, M

“…Tumor tissue oxygenation impacts on proliferation of cancer cells and their sensitivity towards radio- and chemotherapy. Under low oxygen, mammalian cells show…”
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Streptococcus pneumoniae R6 interspecies transformation: genetic analysis of penicillin resistance determinants and genome-wide recombination events by Sauerbier, Julia, Maurer, Patrick, Rieger, Martin, Hakenbeck, Regine

“…Summary Interspecies gene transfer has been implicated as the major driving force for the evolution of penicillin resistance in Streptococcus pneumoniae…”
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Combining ab initio quantum mechanics with a dipole-field model to describe acid dissociation reactions in water: first-principles free energy and entropy calculations by Maurer, Patrick, Iftimie, Radu

“…We introduce a novel approach to compute dissociation free energy and entropy values in simulations that employ a density functional theory description of the…”
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New Aspects of the Interplay between Penicillin Binding Proteins, murM , and the Two-Component System CiaRH of Penicillin-Resistant Streptococcus pneumoniae Serotype 19A Isolates from Hungary by Schweizer, Inga, Blättner, Sebastian, Maurer, Patrick, Peters, Katharina, Vollmer, Daniela, Vollmer, Waldemar, Hakenbeck, Regine, Denapaite, Dalia

“…The clone Hungary -6 expresses unusually high levels of β-lactam resistance, which is in part due to mutations in the MurM gene, encoding a transferase…”
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