SAR-Guided Scoring Function and Mutational Validation Reveal the Binding Mode of CGS-8216 at the α1+/γ2- Benzodiazepine Site
- Author(s)
- David C B Siebert, Marcus Wieder, Lydia Schlener, Petra Scholze, Stefan Boresch, Thierry Langer, Michael Schnürch, Marko D Mihovilovic, Lars Richter, Margot Ernst, Gerhard Ecker
- Organisation(s)
- Department of Biochemistry and Cell Biology, Department of Computational Biological Chemistry
- External organisation(s)
- Technische Universität Wien, Medizinische Universität Wien
- Journal
- Journal of Chemical Information and Modeling
- Volume
- 58
- Pages
- 1682-1696
- No. of pages
- 15
- ISSN
- 1549-9596
- DOI
- https://doi.org/10.1021/acs.jcim.8b00199
- Publication date
- 08-2018
- Peer reviewed
- Yes
- Austrian Fields of Science 2012
- 301207 Pharmaceutical chemistry, 102009 Computer simulation
- Keywords
- ASJC Scopus subject areas
- Chemical Engineering(all), Chemistry(all), Library and Information Sciences, Computer Science Applications
- Portal url
- https://ucris.univie.ac.at/portal/en/publications/sarguided-scoring-function-and-mutational-validation-reveal-the-binding-mode-of-cgs8216-at-the-12-benzodiazepine-site(34746e94-47f6-4fe8-9234-c6f437cd58dd).html