Rapid activity prediction of HIV-1 integrase inhibitors: harnessing docking energetic components for empirical scoring by chemometric and artificial neural network approaches
© 2016, Springer International Publishing Switzerland. Abstract: Improving performance of scoring functions for drug docking simulations is a challenging task in the modern discovery pipeline. Among various ways to enhance the efficiency of scoring function, tuning of energetic component approach is...
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Main Authors: | Patcharapong Thangsunan, Sila Kittiwachana, Puttinan Meepowpan, Nawee Kungwan, Panchika Prangkio, Supa Hannongbua, Nuttee Suree |
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Format: | Journal |
Published: |
2018
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Subjects: | |
Online Access: | https://www.scopus.com/inward/record.uri?partnerID=HzOxMe3b&scp=84975136186&origin=inward http://cmuir.cmu.ac.th/jspui/handle/6653943832/55454 |
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Institution: | Chiang Mai University |
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