The molecular phenomena underlying multimodal chromatographic separations : a molecular dynamics study
Authors
Bilodeau, Camille L.
ORCID
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Other Contributors
Cramer, Steven M.
Garde, Shekhar
Underhill, Patrick T.
Lau, Edmond Y.
Garde, Shekhar
Underhill, Patrick T.
Lau, Edmond Y.
Issue Date
2020-05
Keywords
Chemical engineering
Degree
PhD
Terms of Use
This electronic version is a licensed copy owned by Rensselaer Polytechnic Institute, Troy, NY. Copyright of original work retained by author.
Full Citation
Abstract
This thesis addresses these challenges by exploring the molecular nature of protein-multimodal ligand interactions using molecular dynamics simulations. First, we investigated these complex protein-ligand interactions by developing a representative model system consisting of two bonded molecules (the ligand) binding to a surface (the protein). In this simplified system, it was straightforward to develop an understanding of the nature of synergy as well as explore how the additional complexities affected synergy.
Description
May 2020
School of Engineering
School of Engineering
Department
Dept. of Chemical and Biological Engineering
Publisher
Rensselaer Polytechnic Institute, Troy, NY
Relationships
Rensselaer Theses and Dissertations Online Collection
Access
Restricted to current Rensselaer faculty, staff and students. Access inquiries may be directed to the Rensselaer Libraries.