Knut Baumann
Technische Universität Braunschweig(DE)
Publications by Year
Research Areas
Computational Drug Discovery Methods, Spectroscopy and Chemometric Analyses, Analytical Chemistry and Chromatography, Metabolomics and Mass Spectrometry Studies, Spectroscopy Techniques in Biomedical and Chemical Research
Most-Cited Works
- → Maximum Unbiased Validation (MUV) Data Sets for Virtual Screening Based on PubChem Bioactivity Data(2009)414 cited
- → Cross-validation as the objective function for variable-selection techniques(2003)245 cited
- → Towards a Detailed Understanding of Bacterial Metabolism—Spectroscopic Characterization of Staphylococcus Epidermidis(2006)198 cited
- → ErG: 2D Pharmacophore Descriptions for Scaffold Hopping(2005)183 cited
- → Chemoinformatic Classification Methods and their Applicability Domain(2016)165 cited
- → Reliable estimation of prediction errors for QSAR models under model uncertainty using double cross-validation(2014)164 cited
- → Novel strategies for the formulation and processing of poorly water-soluble drugs