Ngā hua rapu - Li, Youyong

Whakamahine hua
  1. 1
    Responsive Guest Encapsulation of Dynamic Conjugated Microporous Polymers

    Responsive Guest Encapsulation of Dynamic Conjugated Microporous Polymers mā Xu, Lai, Li, Youyong

    I whakaputaina 2016
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  2. 2
    Prediction of peptides binding to the PKA RIIα subunit using a hierarchical strategy

    Prediction of peptides binding to the PKA RIIα subunit using a hierarchical strategy mā Hou, Tingjun, Li, Youyong, Wang, Wei

    I whakaputaina 2011
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  3. 3
    Assessing the performance of the MM/PBSA and MM/GBSA methods: I. The accuracy of binding free energy calculations based on molecular dynamics simulations

    Assessing the performance of the MM/PBSA and MM/GBSA methods: I. The accuracy of binding free energy calculations based on molecular dynamics simulations mā Hou, Tingjun, Wang, Junmei, Li, Youyong, Wang, Wei

    I whakaputaina 2010
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  4. 4
    Assessing the performance of the MM/PBSA and MM/GBSA methods: II. The accuracy of ranking poses generated from docking

    Assessing the performance of the MM/PBSA and MM/GBSA methods: II. The accuracy of ranking poses generated from docking mā Hou, Tingjun, Wang, Junmei, Li, Youyong, Wang, Wei

    I whakaputaina 2010
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  5. 5
    Characterization of Domain–Peptide Interaction Interface: Prediction of SH3 Domain-Mediated Protein–Protein Interaction Network in Yeast by Generic Structure-Based Models

    Characterization of Domain–Peptide Interaction Interface: Prediction of SH3 Domain-Mediated Protein–Protein Interaction Network in Yeast by Generic Structure-Based Models mā Hou, Tingjun, Li, Nan, Li, Youyong, Wang, Wei

    I whakaputaina 2012
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  6. 6
    Theoretical Design of Dithienopicenocarbazole-Based Molecules by Molecular Engineering of Terminal Units Toward Promising Non-fullerene Acceptors

    Theoretical Design of Dithienopicenocarbazole-Based Molecules by Molecular Engineering of Terminal Units Toward Promising Non-fullerene Acceptors mā Feng, Jie, Wang, Hongshuai, Rujisamphan, Nopporn, Li, Youyong

    I whakaputaina 2020
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  7. 7
    New Ti-decorated B(40) fullerene as a promising hydrogen storage material

    New Ti-decorated B(40) fullerene as a promising hydrogen storage material mā Dong, Huilong, Hou, Tingjun, Lee, Shuit-Tong, Li, Youyong

    I whakaputaina 2015
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  8. 8
    P-loop Conformation Governed Crizotinib Resistance in G2032R-Mutated ROS1 Tyrosine Kinase: Clues from Free Energy Landscape

    P-loop Conformation Governed Crizotinib Resistance in G2032R-Mutated ROS1 Tyrosine Kinase: Clues from Free Energy Landscape mā Sun, Huiyong, Li, Youyong, Tian, Sheng, Wang, Junmei, Hou, Tingjun

    I whakaputaina 2014
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  9. 9
    The Selective Interaction between Silica Nanoparticles and Enzymes from Molecular Dynamics Simulations

    The Selective Interaction between Silica Nanoparticles and Enzymes from Molecular Dynamics Simulations mā Sun, Xiaotian, Feng, Zhiwei, Zhang, Liling, Hou, Tingjun, Li, Youyong

    I whakaputaina 2014
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  10. 10
    Design of Boron Doped C(2)N-C(3)N Coplanar Conjugated Heterostructure for Efficient HER Electrocatalysis

    Design of Boron Doped C(2)N-C(3)N Coplanar Conjugated Heterostructure for Efficient HER Electrocatalysis mā Xu, Weiwei, Chen, Chongyang, Tang, Chao, Li, Youyong, Xu, Lai

    I whakaputaina 2018
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  11. 11
    Origin of the catalytic activity of phosphorus doped MoS(2) for oxygen reduction reaction (ORR) in alkaline solution: a theoretical study

    Origin of the catalytic activity of phosphorus doped MoS(2) for oxygen reduction reaction (ORR) in alkaline solution: a theoretical study mā Liu, Cheng, Dong, Huilong, Ji, Yujin, Hou, Tingjun, Li, Youyong

    I whakaputaina 2018
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  12. 12
    Fullerene derivatives act as inhibitors of leukocyte common antigen based on molecular dynamics simulations

    Fullerene derivatives act as inhibitors of leukocyte common antigen based on molecular dynamics simulations mā Yu, Yi, Sun, Huiyong, Hou, Tingjun, Wang, Suidong, Li, Youyong

    I whakaputaina 2018
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  13. 13
    Predicted structures and dynamics for agonists and antagonists bound to serotonin 5-HT2B and 5-HT2C receptors

    Predicted structures and dynamics for agonists and antagonists bound to serotonin 5-HT2B and 5-HT2C receptors mā Kim, Soo-Kyung, Li, Youyong, Abrol, Ravinder, Heo, Jiyoung, Goddard, William A.

    I whakaputaina 2011
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  14. 14
    Prediction of the 3D structure for the rat urotensin II receptor and comparison of the antagonist binding sites and binding selectivity between human and rat from atomistic simulations

    Prediction of the 3D structure for the rat urotensin II receptor and comparison of the antagonist binding sites and binding selectivity between human and rat from atomistic simulat... mā Kim, Soo-Kyung, Li, Youyong, Park, Changmoon, Abrol, Ravinder, Goddard, William A.

    I whakaputaina 2010
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  15. 15
    A rule-based algorithm for automatic bond type perception

    A rule-based algorithm for automatic bond type perception mā Zhang, Qian, Zhang, Wei, Li, Youyong, Wang, Junmei, Zhang, Liling, Hou, Tingjun

    I whakaputaina 2012
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  16. 16
    MORT: a powerful foundational library for computational biology and CADD

    MORT: a powerful foundational library for computational biology and CADD mā Zhang, Qian, Zhang, Wei, Li, Youyong, Wang, Junmei, Zhang, Jian, Hou, Tingjun

    I whakaputaina 2014
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  17. 17
    ADMET Evaluation in Drug Discovery. 12. Development of Binary Classification Models for Prediction of hERG Potassium Channel Blockage

    ADMET Evaluation in Drug Discovery. 12. Development of Binary Classification Models for Prediction of hERG Potassium Channel Blockage mā Wang, Sichao, Li, Youyong, Wang, Junmei, Chen, Lei, Zhang, Liling, Yu, Huidong, Hou, Tingjun

    I whakaputaina 2012
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  18. 18
    Drug-likeness analysis of traditional Chinese medicines: 1. property distributions of drug-like compounds, non-drug-like compounds and natural compounds from traditional Chinese medicines

    Drug-likeness analysis of traditional Chinese medicines: 1. property distributions of drug-like compounds, non-drug-like compounds and natural compounds from traditional Chinese me... mā Shen, Mingyun, Tian, Sheng, Li, Youyong, Li, Qian, Xu, Xiaojie, Wang, Junmei, Hou, Tingjun

    I whakaputaina 2012
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  19. 19
    Platelet Aggregation Pathway Network-Based Approach for Evaluating Compounds Efficacy

    Platelet Aggregation Pathway Network-Based Approach for Evaluating Compounds Efficacy mā Gu, Jiangyong, Li, Qian, Chen, Lirong, Li, Youyong, Hou, Tingjun, Yuan, Gu, Xu, Xiaojie

    I whakaputaina 2013
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  20. 20
    Surface-modulated palladium-nickel icosahedra as high-performance non-platinum oxygen reduction electrocatalysts

    Surface-modulated palladium-nickel icosahedra as high-performance non-platinum oxygen reduction electrocatalysts mā Feng, Yonggang, Shao, Qi, Ji, Yujin, Cui, Xiaoneng, Li, Youyong, Zhu, Xing, Huang, Xiaoqing

    I whakaputaina 2018
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