E-Dissertationen: Browsing E-Dissertationen by Author "Bajorath, Jürgen"
Now showing items 21-25 of 25
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Multi-faceted Structure-Activity Relationship Analysis Using Graphical Representations
Iyer, Preeti Ramesh (2014-02-18)A core focus in medicinal chemistry is the interpretation of structure-activity relationships (SARs) of small molecules. SAR analysis is typically carried out on a case-by-case basis for compound sets that share activity ... -
Systematic Computational Analysis of Structure-Activity Relationships
Peltason, Lisa Bertha (2010-04-20)The exploration of structure–activity relationships (SARs) of small bioactive molecules is a central task in medicinal chemistry. Typically, SARs are analyzed on a case-by-case basis for series of closely related molecules. ... -
Systematic Identification of Scaffolds Representing Different Types of Structure-Activity Relationships
Hu, Ye (2011-07-22)In medicinal chemistry, it is of central importance to understand structure-activity relationships (SARs) of small bioactive compounds. Typically, SARs are analyzed on a case-by-case basis for sets of compounds active ... -
Using whole-genome wide gene expression profiling for the establishment of RNA fingerprints: application to scientific questions in molecular biology, immunology and diagnostics
Eggle, Daniela (2008)This thesis introduces the term RNA fingerprint and applies this concept to different scientific questions in immunology and medical diagnostics. A RNA fingerprint comprises observed transcriptional changes in response ...
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Virtual compound screening and SAR analysis: method development and practical applications in the design of new serine and cysteine protease inhibitors
Sisay, Mihiret Tekeste (2010-11-05)Virtual screening is an important tool in drug discovery that uses different computational methods to screen chemical databases for the identification of possible drug candidates. Most virtual screening methodologies are ...