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Chemical Biology & Drug Design
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July 27, 2023
MicroRNA-577/EIF5A2 axis suppressed the proliferation of DDP-resistant nasopharyngeal carcinoma cells by blocking TGF-β signaling pathway
Renrui Wu, Qiong Zhong, Huafeng Liu, et al.
The Journal of Chemical Physics
|
November 15, 2006
Approximate scaling properties of the density functional theory Tc for atoms
Shubin Liu, Robert C Morrison, Robert G Parr
ACS Applied Materials & Interfaces
|
April 2, 2010
Conjugated polymers based on benzo[2,1-b:3,4-b']dithiophene with low-lying highest occupied molecular orbital energy levels for organic photovoltaics
Shengqiang Xiao, Andrew C Stuart, Shubin Liu, et al.
Molecules (Basel, Switzerland)
|
March 29, 2023
Excited-State Polarizabilities: A Combined Density Functional Theory and Information-Theoretic Approach Study
Dongbo Zhao, Xin He, Paul W Ayers, et al.
The Journal of Physical Chemistry. A
|
December 15, 2025
Distinguishing Aromaticity from Antiaromaticity with Information-Theoretic and Energetic Information Quantities and Their Links to Molecular Properties
Xin He, Wenjian Liu, Paul W Ayers, et al.
The Journal of Chemical Physics
|
March 3, 2011
Origin of anomeric effect: a density functional steric analysis
Ying Huang, Ai-Guo Zhong, Qinsong Yang, et al.
The Journal of Physical Chemistry Letters
|
November 13, 2012
Weakly Antiferromagentic Coupling Via Superexchange Interaction Between Mn(II)-Mn(II) Atoms: A QM/MM Study of the Active Site of Human Cytosolic X-Propyl Aminopeptidase P
Sangwook Wu, Shubin Liu, Sooyeon Sim, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
July 3, 2024
Steric Effect and Intrinsic Electrophilicity and Nucleophilicity from Conceptual Density Functional Theory and Information-Theoretic Approach as Quantitative Probes of Chemical Reactions
Bin Wang, Shubin Liu, Ming Lei, et al.
Journal of Chemical Theory and Computation
|
February 4, 2024
Extending the Scope of Conceptual Density Functional Theory with Second Order Analytical Methodologies
Bin Wang, Paul Geerlings, Shubin Liu, et al.
Physical Chemistry Chemical Physics : PCCP
|
June 20, 2012
Natural orbital Fukui function and application in understanding cycloaddition reaction mechanisms
Panpan Zhou, Paul W Ayers, Shubin Liu, et al.
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Search research articles
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Showing results (61-70 of 234) with videos related to
Sort By:
Page
of 24
Chemical Biology & Drug Design
|
July 27, 2023
MicroRNA-577/EIF5A2 axis suppressed the proliferation of DDP-resistant nasopharyngeal carcinoma cells by blocking TGF-β signaling pathway
Renrui Wu, Qiong Zhong, Huafeng Liu, et al.
The Journal of Chemical Physics
|
November 15, 2006
Approximate scaling properties of the density functional theory Tc for atoms
Shubin Liu, Robert C Morrison, Robert G Parr
ACS Applied Materials & Interfaces
|
April 2, 2010
Conjugated polymers based on benzo[2,1-b:3,4-b']dithiophene with low-lying highest occupied molecular orbital energy levels for organic photovoltaics
Shengqiang Xiao, Andrew C Stuart, Shubin Liu, et al.
Molecules (Basel, Switzerland)
|
March 29, 2023
Excited-State Polarizabilities: A Combined Density Functional Theory and Information-Theoretic Approach Study
Dongbo Zhao, Xin He, Paul W Ayers, et al.
The Journal of Physical Chemistry. A
|
December 15, 2025
Distinguishing Aromaticity from Antiaromaticity with Information-Theoretic and Energetic Information Quantities and Their Links to Molecular Properties
Xin He, Wenjian Liu, Paul W Ayers, et al.
The Journal of Chemical Physics
|
March 3, 2011
Origin of anomeric effect: a density functional steric analysis
Ying Huang, Ai-Guo Zhong, Qinsong Yang, et al.
The Journal of Physical Chemistry Letters
|
November 13, 2012
Weakly Antiferromagentic Coupling Via Superexchange Interaction Between Mn(II)-Mn(II) Atoms: A QM/MM Study of the Active Site of Human Cytosolic X-Propyl Aminopeptidase P
Sangwook Wu, Shubin Liu, Sooyeon Sim, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
July 3, 2024
Steric Effect and Intrinsic Electrophilicity and Nucleophilicity from Conceptual Density Functional Theory and Information-Theoretic Approach as Quantitative Probes of Chemical Reactions
Bin Wang, Shubin Liu, Ming Lei, et al.
Journal of Chemical Theory and Computation
|
February 4, 2024
Extending the Scope of Conceptual Density Functional Theory with Second Order Analytical Methodologies
Bin Wang, Paul Geerlings, Shubin Liu, et al.
Physical Chemistry Chemical Physics : PCCP
|
June 20, 2012
Natural orbital Fukui function and application in understanding cycloaddition reaction mechanisms
Panpan Zhou, Paul W Ayers, Shubin Liu, et al.
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of 24