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Christian Kramer

2 results in Authors: Christian Kramer

Analytical Chemistry

mmpdb: An Open Source Matched Molecular Pair Platform for Large Multi-Property Datasets

Andrew Dalke, Jerome Hert, Christian Kramer

Version 1 posted 19 March 2018

1,413

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Biological and Medicinal Chemistry

Expediting hit-to-lead progression in drug discovery through reaction prediction and multi-objective molecular optimization

David F. Nippa, Kenneth Atz, Yannick Stenzhorn, Alex T. Müller, Andreas Tosstorff, Jörg Benz, Hayley Binch, Markus Bürkler, Achi Haider, Dominik Heer, Remo Hochstrasser, Christian Kramer, Michael Reutlinger, Petra Schneider, Thierry Shema, Andreas Topp, Alexander Walter, Matthias B. Wittwer, Jens Wolfard, Bernd Kuhn, Mario van der Stelt, Rainer E. Martin, Uwe Grether, Gisbert Schneider

Version 2 posted 29 January 2025

1,377

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