Emanuel S. R. Ehmki

Comparing Molecular Patterns Using the Example of SMARTS: Theory and Algorithms

Robert Schmidt, Emanuel S. R. Ehmki, Farina Ohm et al. · Journal of Chemical Information and Modeling · 2019 · 47 citations

Pharmacy, Chemistry, Computational Chemistry +12

SMARTS.plus – A Toolbox for Chemical Pattern Design

Christiane Ehrt, Bennet Krause, Robert Schmidt et al. · Molecular Informatics · 2020 · 30 citations · Full text

Pharmacy, Chemistry, Medicinal Chemistry +13

Comparing Molecular Patterns Using the Example of SMARTS: Applications and Filter Collection Analysis

Emanuel S. R. Ehmki, Robert Schmidt, Farina Ohm et al. · Journal of Chemical Information and Modeling · 2019 · 24 citations

Pharmacy, Chemistry, Computer Science +16

Kinetic barriers in the isomerization of substituted ureas: implications for computer-aided drug design

Johannes R. Loeffler, Emanuel S. R. Ehmki, Julian E. Fuchs et al. · Journal of Computer-Aided Molecular Design · 2016 · 11 citations · Full text

Natural Sciences, Chemistry, Medicinal Chemistry +15

Matched Molecular Series: Measuring SAR Similarity

Emanuel S. R. Ehmki, Christian Krämer · Journal of Chemical Information and Modeling · 2017 · 11 citations

Pharmacy, Medicinal Chemistry, Drug Design +16