ChemGPS-NP and the Exploration of Biologically Relevant Chemical Space
Chemical space is basically infinite, and comprises all molecules that could possibly exist. Intelligent ways to efficiently navigate through chemical space and to select promising compounds in drug discovery are important tasks, and the focus of this thesis. In this work a new model for chemical sp...
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Format: | Doctoral Thesis |
Language: | English |
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Uppsala universitet, Institutionen för läkemedelskemi
2009
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Online Access: | http://urn.kb.se/resolve?urn=urn:nbn:se:uu:diva-89364 http://nbn-resolving.de/urn:isbn:978-91-554-7431-7 |