Sökning: "simulation embedding method"

Visar resultat 6 - 8 av 8 avhandlingar innehållade orden simulation embedding method.

  1. 6. Computational Studies of Protein-ligand Systems Using Enhanced Sampling Methods

    Författare :Rongfeng Zou; Yaoquan Tu; Leif Eriksson; KTH; []
    Nyckelord :molecular dynamics; enhanced sampling; protein-ligand interactions; umbrella sampling; metadynamics; Teoretisk kemi och biologi; Theoretical Chemistry and Biology;

    Sammanfattning : This thesis focuses on studies of protein-ligand systems using enhanced sampling methods. In chapter I, I give a brief introduction to the time-scale problem and some enhanced sampling methods. In chapter II, the basics of MD simulation are reviewed. LÄS MER

  3. 7. Advancing Modeling and Tracking of Deformable Linear Objects for Real-World Applications

    Författare :Yuxuan Yang; Todor Stoyanov; Johannes A Stork; Ville Kyrki; Örebro universitet; []
    Nyckelord :NATURVETENSKAP; NATURAL SCIENCES; Deformable Linear Object; Model Learning; Model-based Control; Tracking; Robustness;

    Sammanfattning : Deformable linear objects (DLOs), such as cables, wires, ropes, and sutures, are important components in various applications in robotics. Although automating DLO manipulation tasks through robot deployment can offer benefits in terms of cost reduction and increased efficiency, it presents difficult challenges. LÄS MER

  4. 8. Nanostructured Semiconductor Materials for Light Manipulation Functions

    Författare :Dennis Visser; Srinivasan Anand; Alvaro Blanco; KTH; []
    Nyckelord :TEKNIK OCH TEKNOLOGIER; ENGINEERING AND TECHNOLOGY; semiconductor materials; c-Si; a-Si; GaInP; TiO2; ZnO; nanostructuring; light manipulation functions; top-down fabrication; embossing; FDTD simulations; nanowires; nanopillars; nanodisks; microcones; optical response; reflectance; transmittance; absorbance; spectrophotometry; photoluminescence; Mie resonators; mode coupling; broadband anti-reflection; light extraction enhancement; optical sensing; optical color filters; color conversion; Optik och fotonik; Optics and Photonics;

    Sammanfattning : Structuring of semiconductor materials is utilized in many optoelectronic devices, e.g, in order to make them more efficient, cost-effective, and/or to obtain specific wavelength-engineered responses. Semiconductor materials are widely used in optoelectronic devices due to their favorable optical and electric properties. LÄS MER