Automated Building of Organometallic Complexes from 3D Fragments
Author:
Affiliation:
1. Department of Chemistry, University of Bergen, Allégaten 41, N-5007 Bergen, Norway
2. Department of Chemistry, Norwegian University of Science and Technology, Ho̷gskoleringen 1, N-7491 Trondheim, Norway
Funder
The Research Council of Norway
Publisher
American Chemical Society (ACS)
Subject
Library and Information Sciences,Computer Science Applications,General Chemical Engineering,General Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/ci5003153
Reference77 articles.
1. In Silico Design in Homogeneous Catalysis Using Descriptor Modelling
2. De novo structure-based design of anion receptors
3. An Evolutionary Algorithm for de Novo Optimization of Functional Transition Metal Compounds
4. Automated Design of Realistic Organometallic Molecules from Fragments
5. QSPR modeling of enthalpies of formation for organometallic compounds by SMART-based optimal descriptors
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