TY - JOUR A1 - Weber, Marcus A1 - Bujotzek, Alexander A1 - Haag, Rainer T1 - Quantifying the rebinding effect in multivalent chemical ligand-receptor systems JF - J. Chem. Phys. Y1 - 2012 VL - 137 IS - 5 SP - 054111 ER - TY - JOUR A1 - Weber, Marcus A1 - Bujotzek, Alexander A1 - Andrae, Karsten A1 - Weinhart, M. A1 - Haag, Rainer T1 - Computational entropy estimation of linear polyether modified surfaces and correlation with protein resistant properties of such surfaces JF - J. Mol. Sim. Y1 - 2011 ER - TY - JOUR A1 - Shan, Min A1 - Carlson, Kathryn E. A1 - Bujotzek, Alexander A1 - Wellner, Anja A1 - Gust, Ronald A1 - Weber, Marcus A1 - Katzenellenbogen, John A. A1 - Haag, Rainer T1 - Nonsteroidal Bivalent Estrogen Ligands - An Application of the Bivalent Concept to the Estrogen Receptor JF - ACS Chem. Biol. Y1 - 2013 VL - 8 IS - 4 SP - 707 EP - 715 ER - TY - JOUR A1 - Shan, Min A1 - Bujotzek, Alexander A1 - Abendroth, Frank A1 - Seitz, Oliver A1 - Weber, Marcus A1 - Haag, Rainer T1 - Conformational Analysis of Bivalent Estrogen Receptor-Ligands: From Intramolecular to Intermolecular Binding JF - ChemBioChem, 12(17) Y1 - 2011 U6 - https://doi.org/10.1002/cbic.201100529 SP - 2587 EP - 2598 ER - TY - JOUR A1 - Scheibe, Ch. A1 - Bujotzek, Alexander A1 - Dernedde, Jens A1 - Weber, Marcus A1 - Seitz, O. T1 - DNA-programmed spatial screening of carbohydrate-lectin interactions JF - Chem. Sci. Y1 - 2011 VL - 2 SP - 770 EP - 775 ER - TY - JOUR A1 - Koschek, A1 - Durmaz, Vedat A1 - Krylova, A1 - Wieczorek, A1 - Gupta, Pooja A1 - Richter, A1 - Bujotzek, Alexander A1 - Fischer, A1 - Haag, Rainer A1 - Freund, A1 - Weber, Marcus A1 - Rademann, T1 - Peptide polymer ligands for a tandem WW-domain, a soft multivalent protein-protein interaction: lessons on the thermodynamic fitness of flexible ligands JF - Beilstein J. Org. Chem. Y1 - 2015 VL - 11 SP - 837 EP - 847 ER - TY - JOUR A1 - Klimm, Martina A1 - Bujotzek, Alexander A1 - Weber, Marcus T1 - Direct Reweighting Strategies in Conformation Dynamics JF - MATCH Commun. Math. Comp. Chem. Y1 - 2011 VL - 65(2) SP - 333 EP - 346 ER - TY - JOUR A1 - Bujotzek, Alexander A1 - Weber, Marcus T1 - Efficient Simulation of Ligand-Receptor Binding Processes Using the Conformation Dynamics Approach JF - Journal of Bioinformatics and Computational Biology Y1 - 2009 VL - 7(5) SP - 811 EP - 831 ER - TY - JOUR A1 - Bujotzek, Alexander A1 - Shan, Min A1 - Haag, Rainer A1 - Weber, Marcus T1 - Towards a rational spacer design for bivalent inhibition of estrogen receptor JF - J. Comput.-Aided Mol. Des. Y1 - 2011 VL - 25(3) SP - 253 EP - 262 ER - TY - JOUR A1 - Bujotzek, Alexander A1 - Schütt, Ole A1 - Nielsen, Adam A1 - Fackeldey, Konstantin A1 - Weber, Marcus T1 - ZIBgridfree: Efficient Conformational Analysis by Partition-of-Unity Coupling JF - Journal of Mathematical Chemistry Y1 - 2014 U6 - https://doi.org/10.1007/s10910-013-0265-1 VL - 52 IS - 3 SP - 781 EP - 804 ER -