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Structure Based Design of Potential Inhibitors of Steroid Sulfatase., , , , и . IWPACBB, том 74 из Advances in Intelligent and Soft Computing, стр. 151-156. Springer, (2010)ClogPalk: a method for predicting alkane/water partition coefficient., , и . J. Comput. Aided Mol. Des., 27 (5): 389-402 (2013)Ligand efficiency metrics considered harmful., , и . J. Comput. Aided Mol. Des., 28 (7): 699-710 (2014)Automated molecule editing in molecular design., , , , и . J. Comput. Aided Mol. Des., 27 (8): 655-664 (2013)Inflation of correlation in the pursuit of drug-likeness., и . J. Comput. Aided Mol. Des., 27 (1): 1-13 (2013)The influence of hydrogen bonding on partition coefficients., , , , , , и . J. Comput. Aided Mol. Des., 31 (2): 163-181 (2017)Novel Application of 2D and 3D-Similarity Searches To Identify Substrates among Cytochrome P450 2C9, 2D6, and 3A4., , и . J. Chem. Inf. Model., 50 (1): 97-109 (2010)Assessment of Reversibility for Covalent Cysteine Protease Inhibitors Using Quantum Mechanics/Molecular Mechanics Free Energy Surfaces., , , , , , и . J. Chem. Inf. Model., 62 (17): 4083-4094 (2022)Evaluating QM/MM Free Energy Surfaces for Ranking Cysteine Protease Covalent Inhibitors., , , , , и . J. Chem. Inf. Model., 60 (2): 880-889 (2020)Predicting the Relative Binding Affinity for Reversible Covalent Inhibitors by Free Energy Perturbation Calculations., , , , , , и . J. Chem. Inf. Model., 61 (9): 4733-4744 (2021)