Items where Author is "Lill, Markus A."

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Number of items: 7.


Bartolowits, Matthew D. and Gast, Jonathon M. and Hasler, Ashlee J. and Cirrincione, Anthony M. and O'Connor, Rachel J. and Mahmoud, Amr H. and Lill, Markus A. and Davisson, Vincent Jo. (2019) Discovery of Inhibitors for Proliferating Cell Nuclear Antigen Using a Computational-Based Linked-Multiple-Fragment Screen. ACS omega, 4 (12). pp. 15181-15196.

Mahmoud, Amr H. and Yang, Ying and Lill, Markus A.. (2019) Improving Atom-Type Diversity and Sampling in Cosolvent Simulations Using λ-Dynamics. Journal of chemical theory and computation, 15 (5). pp. 3272-3287.

Yang, Ying and Mahmoud, Amr H. and Lill, Markus A.. (2019) Modeling of Halogen-Protein Interactions in Co-Solvent Molecular Dynamics Simulations. Journal of chemical information and modeling, 59 (1). pp. 38-42.

Kaur, Jatinder and Soto-Velasquez, Monica and Ding, Zhong and Ghanbarpour, Ahmadreza and Lill, Markus A. and van Rijn, Richard M. and Watts, Val J. and Flaherty, Daniel P.. (2019) Optimization of a 1,3,4-oxadiazole series for inhibition of Ca; 2+; /calmodulin-stimulated activity of adenylyl cyclases 1 and 8 for the treatment of chronic pain. European journal of medicinal chemistry, 162. pp. 568-585.

Cassell, Robert J. and Mores, Kendall L. and Zerfas, Breanna L. and Mahmoud, Amr H. and Lill, Markus A. and Trader, Darci J. and van Rijn, Richard M.. (2019) Rubiscolins are naturally occurring G protein-biased delta opioid receptor peptides. European neuropsychopharmacology : the journal of the European College of Neuropsychopharmacology, 29 (3). pp. 450-456.


Sadeghi, Ali and Ghasemi, S. Alireza and Schaefer, Bastian and Mohr, Stephan and Lill, Markus A. and Goedecker, Stefan. (2013) Metrics for measuring distances in configuration spaces. Journal of Chemical Physics, 139 (18). p. 184118.


Spreafico, Morena and Ernst, Beat and Lill, Markus A. and Smiesko, Martin and Vedani, Angelo. (2009) Mixed-Model QSAR at the Glucocorticoid Receptor: Predicting the Binding Mode and Affinity of Psychotropic Drugs. ChemMedChem, 4 (1). pp. 100-109.

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