Concepedia

Activity cliff for 7-substituted pyrrolo-pyrimidine inhibitors of HCK explained in terms of predicted basicity of the amine nitrogen

Hitomi Yuki, Ko Kikuzato, Yasuko Koda, Junko Mikuni, Yuri Tomabechi, Mutsuko Kukimoto‐Niino, Akiko Tanaka, Fumiyuki Shirai, Mikako Shirouzu, Hiroo Koyama,

Bioorganic & Medicinal Chemistry · 2017 · 10 citations · 20 references

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20

Epik: a software program for pK a prediction and protonation state generation for drug-like molecules

John C. Shelley, Anuradha Cholleti, Leah L. Frye et al. · Journal of Computer-Aided Molecular Design · 2007 · 2.1K citations

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Jaguar: A high‐performance quantum chemistry software program with strengths in life and materials sciences

Arteum D. Bochevarov, Edward Harder, Thomas F. Hughes et al. · International Journal of Quantum Chemistry · 2013 · 1.8K citations · Full text

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Anthracycline Dose Intensification in Acute Myeloid Leukemia

Hugo F. Fernández, Zhuoxin Sun, Xiaopan Yao et al. · New England Journal of Medicine · 2009 · 907 citations · Full text

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Identification of Therapeutic Targets for Quiescent, Chemotherapy-Resistant Human Leukemia Stem Cells

Yoriko Saito, Hiroshi Kitamura, Atsushi Hijikata et al. · Science Translational Medicine · 2010 · 458 citations · Full text

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Exploring Activity Cliffs in Medicinal Chemistry

Dagmar Stumpfe, Jürgen Bajorath · Journal of Medicinal Chemistry · 2012 · 365 citations · Full text

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