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Relating Chemical Structure to Cellular Response: An Integrative Analysis of Gene Expression, Bioactivity, and Structural Data Across 11,000 Compounds

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http://europepmc.org/articles/PMC4625862?pdf=render
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Abstract

© 2015 The Authors CPT: Pharmacometrics & Systems Pharmacology published by Wiley Periodicals, Inc. on behalf of American Society for Clinical Pharmacology and Therapeutics.A central premise in systems pharmacology is that structurally similar compounds ha

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