Markus Hartenfeller

DOGS: Reaction-Driven de novo Design of Bioactive Compounds

Markus Hartenfeller, Heiko Zettl, Miriam Walter et al. · PLoS Computational Biology · 2012 · 261 citations · Full text

A Collection of Robust Organic Synthesis Reactions for <i>In Silico</i> Molecule Design

Markus Hartenfeller, Martin Eberle, Peter Meier et al. · Journal of Chemical Information and Modeling · 2011 · 119 citations

Combinatorial Chemistry, Focused Collection, Medicinal Chemistry +14

Enabling future drug discovery by <i>de novo</i> design

Markus Hartenfeller, Gisbert Schneider · Wiley Interdisciplinary Reviews Computational Molecular Science · 2011 · 87 citations

Drug Target, Molecular Biology, Virtual Compound Construction +17

Concept of Combinatorial <i>De Novo</i> Design of Drug‐like Molecules by Particle Swarm Optimization

Markus Hartenfeller, Ewgenij Proschak, Andreas Schüller et al. · Chemical Biology & Drug Design · 2008 · 68 citations

Combinatorial Chemistry, Engineering, Molecular Biology +19

Probing the Bioactivity-Relevant Chemical Space of Robust Reactions and Common Molecular Building Blocks

Markus Hartenfeller, Martin Eberle, Peter Meier et al. · Journal of Chemical Information and Modeling · 2012 · 40 citations