Search Results - "Bieniek, K."

Refine Results
  1. 1

    Decision-analytic modeling for health economic evaluation in child and adolescent psychiatry using inpatient equivalent treatment - design of a doctoral thesis by Bieniek, K., Neumann, A., Buchberger, B.

    Published in European psychiatry (01-06-2022)
    “…Introduction Despite the high prevalence of psychiatric disorders among children and adolescents, services are often accessed too late or not at all…”
    Get full text
    Journal Article
  2. 2

    An open-source molecular builder and free energy preparation workflow by Bieniek, Mateusz K., Cree, Ben, Pirie, Rachael, Horton, Joshua T., Tatum, Natalie J., Cole, Daniel J.

    Published in Communications chemistry (27-10-2022)
    “…Automated free energy calculations for the prediction of binding free energies of congeneric series of ligands to a protein target are growing in popularity,…”
    Get full text
    Journal Article
  3. 3
  4. 4

    Elevated plasma il-8 concentration is related to severity of systemic inflammation in chronic spontaneous urticaria by Kasperska-Zajac, A, Grzanka, A, Damasiewicz-Bodzek, A, Bieniek, K, Skrzypulec-Frankel, A, Stencel-Gabriel, K, Sikora-Zydek, A

    “…Chronic spontaneous urticaria (CSU) is associated with activation of acute phase response. Questions arise regarding its association with other inflammatory…”
    Get more information
    Journal Article
  5. 5

    Long Time Scale Ensemble Methods in Molecular Dynamics: Ligand–Protein Interactions and Allostery in SARS-CoV‑2 Targets by Bhati, Agastya P., Hoti, Art, Potterton, Andrew, Bieniek, Mateusz K., Coveney, Peter V.

    Published in Journal of chemical theory and computation (13-06-2023)
    “…We subject a series of five protein–ligand systems which contain important SARS-CoV-2 targets, 3-chymotrypsin-like protease (3CLPro), papain-like protease, and…”
    Get full text
    Journal Article
  6. 6

    TIES 20: Relative Binding Free Energy with a Flexible Superimposition Algorithm and Partial Ring Morphing by Bieniek, Mateusz K, Bhati, Agastya P, Wan, Shunzhou, Coveney, Peter V

    Published in Journal of chemical theory and computation (09-02-2021)
    “…The TIES (Thermodynamic Integration with Enhanced Sampling) protocol is a formally exact alchemical approach in computational chemistry to the calculation of…”
    Get full text
    Journal Article
  7. 7

    TIES 2.0: A Dual-Topology Open Source Relative Binding Free Energy Builder with Web Portal by Bieniek, Mateusz K., Wade, Alexander D., Bhati, Agastya P., Wan, Shunzhou, Coveney, Peter V.

    “…Relative binding free energy (RBFE) calculations are widely used to aid the process of drug discovery. TIES, Thermodynamic Integration with Enhanced Sampling,…”
    Get full text
    Journal Article
  8. 8
  9. 9
  10. 10

    Minor Chemistry Changes Alter Surface Hydration to Control Fibronectin Adsorption and Assembly into Nanofibrils by Bieniek, Mateusz K., Llopis‐Hernandez, Virginia, Douglas, Katie, Salmeron‐Sanchez, Manuel, Lorenz, Christian D.

    Published in Advanced theory and simulations (01-12-2019)
    “…Fibronectin (FN) is a large glycoprotein which links and transmits signals between the cell's cytoskeleton and the extracellular matrix. FN organization into…”
    Get full text
    Journal Article
  11. 11

    Anisotropic effect of regular particle distribution in elastic–plastic composites: The modified tangent cluster model and numerical homogenization by Bieniek, K., Majewski, M., Hołobut, P., Kowalczyk-Gajewska, K.

    “…Estimation of macroscopic properties of heterogeneous materials has always posed significant problems. Procedures based on numerical homogenization, although…”
    Get full text
    Journal Article
  12. 12

    Tumor necrosis factor and interferon activity in the circulation of calves after repeated injection of low doses of lipopolysaccharide by Bieniek, Kazimierz, Szuster-Ciesielska, Agnieszka, Kamińska, Teresa, Kondracki, Marian, Witek, Maria, Kandefer-Szerszeń, Martyna

    Published in Veterinary immunology and immunopathology (30-04-1998)
    “…The effect of two intravenous (iv) injections of low doses of lipopolysaccharide (LPS)(0.1 μg/kg of body weight) administered at 7-day intervals on the…”
    Get full text
    Journal Article
  13. 13

    Removable partial denture production in western Germany by Owall, G, Bieniek, K W, Spiekermann, H

    “…Removable partial denture production in western Germany was studied by analyzing 1,082 photographs taken in consecutive series at five large dental…”
    Get more information
    Journal Article
  14. 14

    Methylation of the BRCA1 promoter in peripheral blood DNA is associated with triple-negative and medullary breast cancer by Gupta, Satish, Jaworska-Bieniek, Katarzyna, Narod, Steven A., Lubinski, Jan, Wojdacz, Tomasz K., Jakubowska, Anna

    Published in Breast cancer research and treatment (01-12-2014)
    “…It has been proposed that methylation signatures in blood-derived DNA may correlate with cancer risk. In this study, we evaluated whether methylation of the…”
    Get full text
    Journal Article
  15. 15

    Bacterial foci in the teeth, oral cavity, and jaw--secondary effects (remote action) of bacterial colonies with respect to bacteriospermia and subfertility in males by Bieniek, K W, Riedel, H H

    Published in Andrologia (01-05-1993)
    “…Bacteriospermia requiring medical treatment were diagnosed in more than 70% of the subfertile patients who had since 1988 attended the gynecological clinic at…”
    Get more information
    Journal Article
  16. 16
  17. 17

    Can selenium be a modifier of cancer risk in CHEK2 mutation carriers? by Gupta, Satish, Jaworska-Bieniek, Katarzyna, Lubiński, Jan, Jakubowska, Anna

    Published in Mutagenesis (01-11-2013)
    “…Selenium is an essential trace element for humans, playing an important role in various major metabolic pathways. Selenium helps to protect the body from the…”
    Get full text
    Journal Article
  18. 18
  19. 19

    Effect of duodenal glucose infusion on blood glucose concentration in endotoxin-treated calves by Bieniek, K

    “…The effect of endotoxemia on the intestinal absorption of glucose was evaluated in nine experiments performed on seven 3- to 5-week-old calves fitted with a…”
    Get more information
    Journal Article
  20. 20

    Minimal andrological requirements for in-vitro fertilization by Riedel, H H, Hübner, F, Ensslen, S C, Bieniek, K W, Grillo, M

    Published in Human reproduction (Oxford) (01-11-1989)
    “…The ejaculate used for in-vitro fertilization of human oocytes must fulfil minimum requirements. Based on the results of experimental investigations, total…”
    Get more information
    Journal Article