Search Results - "SOLANO, Carlos"

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    Characterization of Ciprofloxacin Permeation Pathways across the Porin OmpC Using Metadynamics and a String Method by Prajapati, Jigneshkumar Dahyabhai, Fernández Solano, Carlos José, Winterhalter, Mathias, Kleinekathöfer, Ulrich

    Published in Journal of chemical theory and computation (12-09-2017)
    “…The rapid spreading of antimicrobial resistance in Gram-negative bacteria has become a major threat for humans as well as animals. As one of the main factors…”
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    Enrofloxacin Permeation Pathways across the Porin OmpC by Prajapati, Jigneshkumar Dahyabhai, Solano, Carlos José Fernández, Winterhalter, Mathias, Kleinekathöfer, Ulrich

    Published in The journal of physical chemistry. B (01-02-2018)
    “…In Gram-negative bacteria, the lack or quenching of antibiotic translocation across the outer membrane is one of the main factors for acquiring antibiotic…”
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    Simulations of outer membrane channels and their permeability by Pothula, Karunakar R., Solano, Carlos J.F., Kleinekathöfer, Ulrich

    Published in Biochimica et biophysica acta (01-07-2016)
    “…Channels in the outer membrane of Gram-negative bacteria provide essential pathways for the controlled and unidirectional transport of ions, nutrients and…”
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    Brownian Dynamics Approach Including Explicit Atoms for Studying Ion Permeation and Substrate Translocation across Nanopores by Solano, Carlos J. F, Prajapati, Jigneshkumar D, Pothula, Karunakar R, Kleinekathöfer, Ulrich

    Published in Journal of chemical theory and computation (11-12-2018)
    “…A Brownian dynamics (BD) approach including explicit atoms called BRODEA is presented to model ion permeation and molecule translocation across a nanopore…”
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    Bacterial and Fungal Gut Dysbiosis and Clostridium difficile in COVID-19: A Review by Linares-García, Laura, Cárdenas-Barragán, María E., Hernández-Ceballos, Winston, Pérez-Solano, Carlos S., Morales-Guzmán, Alizon S., Miller, Danielle S., Schmulson, Max

    Published in Journal of clinical gastroenterology (01-04-2022)
    “…Gastrointestinal symptoms are common in Coronavirus Disease 2019 (COVID-19), related to infection of severe acute respiratory syndrome-coronavirus-2…”
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    Experimental and Computational Models for Side Chain Discrimination in Peptide–Protein Interactions by Lidskog, Anna, Dawaigher, Sami, Solano Arribas, Carlos, Ryberg, Anna, Jensen, Jacob, Bergquist, Karl Erik, Sundin, Anders, Norrby, Per‐Ola, Wärnmark, Kenneth

    Published in Chemistry : a European journal (26-07-2021)
    “…A bis(18‐crown‐6) Tröger's base receptor and 4‐substituted hepta‐1,7‐diyl bisammonium salt ligands have been used as a model system to study the interactions…”
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    Can elastic waveform inversion benefit from inverting multicomponent data? by Solano, Carlos Pérez, Plessix, Rene-Edouard

    Published in Leading edge (Tulsa, Okla.) (01-03-2023)
    “…Waveform inversion aims to retrieve high-resolution earth parameter volumes. Due to its high computational cost, acoustic approaches using low to mid seismic…”
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    Modified surface boundary conditions for elastic waveform inversion of low-frequency wide-angle active land seismic data by Plessix, René-Édouard, Pérez Solano, Carlos A.

    Published in Geophysical journal international (01-06-2015)
    “…In presence of large wavelength-scale shear-velocity variations in the Earth, acoustic waveform inversion may not be sufficient even when inverting long-offset…”
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    Integrating reasoning and clinical archetypes using OWL ontologies and SWRL rules by Lezcano, Leonardo, Sicilia, Miguel-Angel, Rodríguez-Solano, Carlos

    Published in Journal of biomedical informatics (01-04-2011)
    “…Semantic interoperability is essential to facilitate the computerized support for alerts, workflow management and evidence-based healthcare across…”
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    BROMOCEA Code: An Improved Grand Canonical Monte Carlo/Brownian Dynamics Algorithm Including Explicit Atoms by Solano, Carlos J. F, Pothula, Karunakar R, Prajapati, Jigneshkumar D, De Biase, Pablo M, Noskov, Sergei Yu, Kleinekathöfer, Ulrich

    Published in Journal of chemical theory and computation (10-05-2016)
    “…All-atom molecular dynamics simulations have a long history of applications studying ion and substrate permeation across biological and artificial pores. While…”
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    Design, Synthesis and Inhibitory Activity of Photoswitchable RET Kinase Inhibitors by Ferreira, Rubén, Nilsson, Jesper R., Solano, Carlos, Andréasson, Joakim, Grøtli, Morten

    Published in Scientific reports (06-05-2015)
    “…REarranged during Transfection (RET) is a transmembrane receptor tyrosine kinase required for normal development and maintenance of neurons of the central and…”
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    Analysis of electromagnetic forces and causality in electron microscopy by Reyes-Coronado, Alejandro, Ortíz-Solano, Carlos Gael, Zabala, Nerea, Rivacoba, Alberto, Esquivel-Sirvent, Raúl

    Published in Ultramicroscopy (01-09-2018)
    “…•Non-causal extrapolated dielectric functions cause a pre-echo in the induced dipole.•A direct and efficient method to detect non-causal dielectric functions…”
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