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Journal of Biomolecular Structure and Dynamics Volume 38, 2020 - Issue 2
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Letters to the Editor

Integrating molecular dynamics simulation and molecular mechanics/generalized Born surface area calculation into pharmacophore modeling: a case study on the proviral integration site for Moloney murine leukemia virus (Pim)-1 kinase inhibitors

Jian GaoJiangsu Key Laboratory of New Drug Research and Clinical Pharmacy, Xuzhou Medical University, Xuzhou, P. R. China; Correspondence[email protected] [email protected]
ORCID Iconhttp://orcid.org/0000-0001-6723-0490View further author information
ORCID Icon,
Yan WangJiangsu Key Laboratory of New Drug Research and Clinical Pharmacy, Xuzhou Medical University, Xuzhou, P. R. China; View further author information
,
Qingqing ChenJiangsu Key Laboratory of New Drug Research and Clinical Pharmacy, Xuzhou Medical University, Xuzhou, P. R. China; View further author information
&
Ruosi YaoDepartment of Hematology, The Affiliated Hospital of Xuzhou Medical University, Xuzhou, P. R. China; ;Blood Diseases Institute Xuzhou Medical University, Xuzhou, P. R. ChinaView further author information
Pages 581-588 | Received 27 Nov 2018, Accepted 15 Jan 2019, Published online: 07 Feb 2019

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