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Journal of Chemical Information and Modeling
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March 27, 2007
ADME evaluation in drug discovery. 6. Can oral bioavailability in humans be effectively predicted by simple molecular property-based rules?
Tingjun Hou, Junmei Wang, Wei Zhang, et al.
Drug Discovery Today
|
September 27, 2022
Machine learning methods for pK<sub>a</sub> prediction of small molecules: Advances and challenges
Jialu Wu, Yu Kang, Peichen Pan, et al.
Journal of Chemical Information and Modeling
|
August 20, 2013
Insight into crizotinib resistance mechanisms caused by three mutations in ALK tyrosine kinase using free energy calculation approaches
Huiyong Sun, Youyong Li, Dan Li, et al.
Proteins
|
September 20, 2011
Characterization of PDZ domain-peptide interaction interface based on energetic patterns
Nan Li, Tingjun Hou, Bo Ding, et al.
Bioorganic & Medicinal Chemistry Letters
|
December 3, 2014
Synthesis and antiproliferative evaluation of 2-hydroxylated (E)-stilbenes
Yan Zhang, Mingyun Shen, Sunliang Cui, et al.
Journal of Chemical Information and Modeling
|
September 25, 2012
Theoretical studies on the susceptibility of oseltamivir against variants of 2009 A/H1N1 influenza neuraminidase
Lin Li, Youyong Li, Liling Zhang, et al.
Frontiers in Chemistry
|
February 26, 2024
Editorial: <i>In silico</i> gating mechanism studies and modulator discovery for MscL
Junmei Wang, Paul Blount, Tingjun Hou, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
March 14, 2012
The influence of defects on Mo-doped TiO2 by first-principles studies
Xiaohui Yu, Tingjun Hou, Xuhui Sun, et al.
ACS Applied Materials & Interfaces
|
May 8, 2014
Mechanism of graphene oxide as an enzyme inhibitor from molecular dynamics simulations
Xiaotian Sun, Zhiwei Feng, Tingjun Hou, et al.
Journal of Biomolecular Structure & Dynamics
|
August 15, 2012
The flexibility of P-glycoprotein for its poly-specific drug binding from molecular dynamics simulations
Ming Liu, Tingjun Hou, Zhiwei Feng, et al.
Page
of 47
Search research articles
Search
Showing results (41-50 of 464) with videos related to
Sort By:
Page
of 47
Journal of Chemical Information and Modeling
|
March 27, 2007
ADME evaluation in drug discovery. 6. Can oral bioavailability in humans be effectively predicted by simple molecular property-based rules?
Tingjun Hou, Junmei Wang, Wei Zhang, et al.
Drug Discovery Today
|
September 27, 2022
Machine learning methods for pK<sub>a</sub> prediction of small molecules: Advances and challenges
Jialu Wu, Yu Kang, Peichen Pan, et al.
Journal of Chemical Information and Modeling
|
August 20, 2013
Insight into crizotinib resistance mechanisms caused by three mutations in ALK tyrosine kinase using free energy calculation approaches
Huiyong Sun, Youyong Li, Dan Li, et al.
Proteins
|
September 20, 2011
Characterization of PDZ domain-peptide interaction interface based on energetic patterns
Nan Li, Tingjun Hou, Bo Ding, et al.
Bioorganic & Medicinal Chemistry Letters
|
December 3, 2014
Synthesis and antiproliferative evaluation of 2-hydroxylated (E)-stilbenes
Yan Zhang, Mingyun Shen, Sunliang Cui, et al.
Journal of Chemical Information and Modeling
|
September 25, 2012
Theoretical studies on the susceptibility of oseltamivir against variants of 2009 A/H1N1 influenza neuraminidase
Lin Li, Youyong Li, Liling Zhang, et al.
Frontiers in Chemistry
|
February 26, 2024
Editorial: <i>In silico</i> gating mechanism studies and modulator discovery for MscL
Junmei Wang, Paul Blount, Tingjun Hou, et al.
Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry
|
March 14, 2012
The influence of defects on Mo-doped TiO2 by first-principles studies
Xiaohui Yu, Tingjun Hou, Xuhui Sun, et al.
ACS Applied Materials & Interfaces
|
May 8, 2014
Mechanism of graphene oxide as an enzyme inhibitor from molecular dynamics simulations
Xiaotian Sun, Zhiwei Feng, Tingjun Hou, et al.
Journal of Biomolecular Structure & Dynamics
|
August 15, 2012
The flexibility of P-glycoprotein for its poly-specific drug binding from molecular dynamics simulations
Ming Liu, Tingjun Hou, Zhiwei Feng, et al.
Page
of 47