Timeline

  1. Burai Patrascu, M., Pottel, J., Pinus, S., Bezanson, M., Norrby, P-O., Moitessier, N. From Desktop to Benchtop with Automated Computational Workflows for Computer Aided Design in Asymmetric Catalysis. Nature Catalysis 2020, 3, 574–584. link

  2. Pottel J., Moitessier N. Customizable Generation of Synthetically Accessible, Local Chemical Subspaces. Journal of Chemical Information and Modeling 2017, 57, 454–467. link

  3. Weill N., Corbeil C.R., De Schutter J.W., Moitessier N., Toward a computational tool predicting the stereochemical outcome of asymmetric reactions: Development of the molecular mechanics-based program ACE and application to asymmetric epoxidation reactions. Journal of Computational Chemistry 2011, 32, 2878-2889. link

  4. Corbeil C.R., Moitessier N., Theory and application of medium to high throughput prediction method techniques for asymmetric catalyst design. Journal of Molecular Catalysis A: Chemical 2010, 324, 146-155. link

  5. Corbeil C.R., Thielges S., Schwartzentruber J.A., Moitessier N., Toward a computational tool predicting the stereochemical outcome of asymmetric reactions: Development and application of a rapid and accurate program based on organic principles. Angewandte Chemie - International Edition 2008, 47, 2635-2638. link

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