Expanding the Toolbox for Computational Analysis in Rational Drug Discovery: Using Biomolecular Solvation to Predict Thermodynamic, Kinetic and Structural Properties of Protein-Ligand Complexes

Most biomolecular interactions occur in aqueous environment. Therefore, one must consider the interactions between proteins and water molecules when developing a drug molecule against a target protein. The study of these interactions is challenging using experimental techniques alone, therefore comp...

Popoln opis

Shranjeno v:
Bibliografske podrobnosti
Glavni avtor: Hüfner, Tobias
Drugi avtorji: Klebe, Gerhard (Prof. Dr.) (BetreuerIn (Doktorarbeit))
Format: Dissertation
Jezik:angleščina
Izdano: Philipps-Universität Marburg 2019
Teme:
Online dostop:PDF-Volltext
Oznake: Označite
Brez oznak, prvi označite!

Internet

PDF-Volltext

Podrobnosti zaloge
Signatura: urn:nbn:de:hebis:04-z2019-04947
Publikationsdatum: 2019-09-11
Datum der Annahme: 2019-10-22
Downloads: 117 (2024), 140 (2023), 87 (2022), 61 (2021), 13 (2020)
Lizenz: https://creativecommons.org/licenses/by-nc-nd/4.0/
Zugangs-URL: https://archiv.ub.uni-marburg.de/diss/z2019/0494
https://doi.org/10.17192/z2019.0494