Hanna Geppert

发表

Searching for Target-Selective Compounds Using Different Combinations of Multiclass Support Vector Machine Ranking Methods, Kernel Functions, and Fingerprint Descriptors

Anne Mai Wassermann, Hanna Geppert, Jürgen Bajorath, 2009, J. Chem. Inf. Model..

Support-Vector-Machine-Based Ranking Significantly Improves the Effectiveness of Similarity Searching Using 2D Fingerprints and Multiple Reference Compounds

Thomas Gärtner, Hanna Geppert, Stefan Wrobel, 2008, J. Chem. Inf. Model..

Advances in 2D fingerprint similarity searching

Hanna Geppert, Jürgen Bajorath, J. Bajorath, 2010, Expert opinion on drug discovery.

Ligand Prediction from Protein Sequence and Small Molecule Information Using Support Vector Machines and Fingerprint Descriptors

Thomas Gärtner, Hanna Geppert, Jürgen Bajorath, 2009, J. Chem. Inf. Model..

Integrating Structure‐ and Ligand‐Based Virtual Screening: Comparison of Individual, Parallel, and Fused Molecular Docking and Similarity Search Calculations on Multiple Targets

Hanna Geppert, Jürgen Bajorath, Lu Tan, 2008, ChemMedChem.

Ligand Prediction for Orphan Targets Using Support Vector Machines and Various Target-Ligand Kernels Is Dominated by Nearest Neighbor Effects

Anne Mai Wassermann, Hanna Geppert, Jürgen Bajorath, 2009, J. Chem. Inf. Model..

Application of support vector machine-based ranking strategies to search for target-selective compounds.

Anne Mai Wassermann, Hanna Geppert, Jürgen Bajorath, 2011, Methods in molecular biology.

Shannon Entropy-Based Fingerprint Similarity Search Strategy

Hanna Geppert, Jürgen Bajorath, Yuan Wang, 2009, J. Chem. Inf. Model..

Development of a Method To Consistently Quantify the Structural Distance between Scaffolds and To Assess Scaffold Hopping Potential

Hanna Geppert, Jürgen Bajorath, Martin Vogt, 2011, J. Chem. Inf. Model..

Measuring the coverage of requirements through enterprise architecture models

Hanna Geppert, Stefan Apelt, Thomas Kudla, 2018, 2018 International Conference on Military Communications and Information Systems (ICMCIS).

Internal versus external balancing in the evaluation of graph-based number types

Hanna Geppert, Martin Wilhelm, 2019, SEA².

Current Trends in Ligand-Based Virtual Screening: Molecular Representations, Data Mining Methods, New Application Areas, and Performance Evaluation

Hanna Geppert, Jürgen Bajorath, Martin Vogt, 2010, J. Chem. Inf. Model..

Detection of Defective Requirements using Rule-based Scripts

Hanna Geppert, Daniel Toews, Michael Dembach, 2019, REFSQ Workshops.

Random Reduction in Fingerprint Bit Density Improves Compound Recall in Search Calculations Using Complex Reference Molecules

Hanna Geppert, Jürgen Bajorath, Yuan Wang, 2008, Chemical biology & drug design.

Requirements view for enterprise architectures

Hanna Geppert, Stefan Apelt, Thomas Kudla, 2017, 2017 International Conference on Military Communications and Information Systems (ICMCIS).

In Silico Screening

Hanna Geppert, Jürgen Bajorath, Dagmar Stumpfe, 2010 .

Targeting multifunctional proteins by virtual screening: structurally diverse cytohesin inhibitors with differentiated biological functions.

Hanna Geppert, Jürgen Bajorath, Michael Famulok, 2010, ACS chemical biology.

Methods for Computer‐Aided Chemical Biology. Part 4: Selectivity Searching for Ion Channel Ligands and Mapping of Molecular Fragments as Selectivity Markers

Hanna Geppert, Eugen Lounkine, Jürgen Bajorath, 2009, Chemical biology & drug design.