Is Structure-Based Drug Design Ready for Selectivity Optimization?
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Published in Journal of chemical information and modeling (28.12.2020)
Published in Journal of chemical information and modeling (28.12.2020)
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General Theory of Fragment Linking in Molecular Design: Why Fragment Linking Rarely Succeeds and How to Improve Outcomes
Yu, Haoyu S, Modugula, Kalyan, Ichihara, Osamu, Kramschuster, Kimberly, Keng, Simon, Abel, Robert, Wang, Lingle
Published in Journal of chemical theory and computation (12.01.2021)
Published in Journal of chemical theory and computation (12.01.2021)
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Journal Article
Is structure based drug design ready for selectivity optimization?
Albanese, Steven K, Chodera, John D, Volkamer, Andrea, Keng, Simon, Abel, Robert, Lingle Wang
Published in bioRxiv (22.09.2020)
Published in bioRxiv (22.09.2020)
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