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Durch die Berechnung von Moleküleigenschaften zum gezielten Entwurf von neuen Wirkstoffen.. Supercomputer, том 211 из Informatik-Fachberichte, стр. 147-160. Springer, (1989)DSX: A Knowledge-Based Scoring Function for the Assessment of Protein-Ligand Complexes., и . J. Chem. Inf. Model., 51 (10): 2731-2745 (2011)Molecular Docking Screens Using Comparative Models of Proteins., , , , , и . Journal of Chemical Information and Modeling, 49 (11): 2512-2527 (2009)PDB2PQR: expanding and upgrading automated preparation of biomolecular structures for molecular simulations., , , , , , и . Nucleic Acids Res., 35 (Web-Server-Issue): 522-525 (2007)Methodological developments and strategies for a fast flexible superposition of drug-size molecules., , и . J. Comput. Aided Mol. Des., 13 (1): 35-49 (1999)A 3D QSAR Study on a Set of Dopamine D4 Receptor Antagonists., , , и . Journal of Chemical Information and Computer Sciences, 43 (3): 1020-1027 (2003)Graph-based methods for protein structure comparison., , , и . WIREs Data Mining Knowl. Discov., 3 (5): 307-320 (2013)Use of 3D QSAR Models for Database Screening: A Feasibility Study., и . Journal of Chemical Information and Modeling, 48 (2): 384-396 (2008)Large-Scale Mining for Similar Protein Binding Pockets: With RAPMAD Retrieval on the Fly Becomes Real., , , и . Journal of Chemical Information and Modeling, 55 (1): 165-179 (2015)Thermodynamics of protein-ligand interactions as a reference for computational analysis: how to assess accuracy, reliability and relevance of experimental data., и . J. Comput. Aided Mol. Des., 29 (9): 867-883 (2015)