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Publications by Iwan J. P. de Esch
Function-Specific Virtual Screening for GPCR Ligands Using a Combined Scoring Method
Scientific Reports
Multidisciplinary
Fragment-Based Screening in Tandem With Phenotypic Screening Provides Novel Antiparasitic Hits
Journal of Biomolecular Screening
Molecular Medicine
Pharmacology
Biochemistry
Analytical Chemistry
Biotechnology
Drug Discovery
Related publications
Vinardo: A Scoring Function Based on Autodock Vina Improves Scoring, Docking, and Virtual Screening
PLoS ONE
Multidisciplinary
Improved Virtual Screening Performance Through Docking Scoring Fusion in the Discovery of Dual Target Ligands for Parkinson’s Disease
Increasing the Virtual Screening Quality to Identify Adrenergic Β2 Receptor Ligands Using Classification Trees
Identification of Estrogen Receptor Α Ligands With Virtual Screening Techniques
Journal of Molecular Graphics and Modelling
Computer Graphics
Theoretical Chemistry
Materials Chemistry
Computer-Aided Design
Spectroscopy
Physical
Representability of Algebraic Topology for Biomolecules in Machine Learning Based Scoring and Virtual Screening
PLoS Computational Biology
Molecular Neuroscience
Evolution
Ecology
Genetics
Behavior
Molecular Biology
Systematics
Simulation
Cellular
Computational Theory
Mathematics
Modeling
Frequent Substructure Mining of GPCR Ligands
Chemistry Central Journal
Chemistry
Computed Tomography Colonography (Virtual Colonoscopy): A New Method for Colorectal Screening
Gut
Gastroenterology
A Virtual Work Principle Using Penalty Function Method for Impact Contact Problems of Two Bodies.
Transactions of the Japan Society of Mechanical Engineers Series A
Syntenator: Multiple Gene Order Alignments With a Gene-Specific Scoring Function
Algorithms for Molecular Biology
Computational Theory
Applied Mathematics
Structural Biology
Molecular Biology
Mathematics
