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Plos Computational Biology
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August 13, 2016
Defining the Product Chemical Space of Monoterpenoid Synthases
Boxue Tian, C Dale Poulter, Matthew P Jacobson
Trends in Biochemical Sciences
|
July 7, 2014
Leveraging structure for enzyme function prediction: methods, opportunities, and challenges
Matthew P Jacobson, Chakrapani Kalyanaraman, Suwen Zhao, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
January 13, 2010
Hydroxylation and ring-opening mechanism of an unusual flavoprotein monooxygenase, 2-methyl-3-hydroxypyridine-5-carboxylic acid oxygenase: a theoretical study
Boxue Tian, Yaoquan Tu, Ake Strid, et al.
Journal of Chemical Theory and Computation
|
December 1, 2015
Can Range-Separated and Hybrid DFT Functionals Predict Low-Lying Excitations? A Tookad Case Study
Boxue Tian, Emma S E Eriksson, Leif A Eriksson
Cell Reports
|
November 27, 2025
Spring-like mechanics enable rapid inactivation and stochastic single-channel gating of the mechanically activated PIEZO channel
Wenhao Liu, Xiaochun Zhang, Qijing He, et al.
Chemical Science
|
January 10, 2022
Controlled movement of ssDNA conjugated peptide through <i>Mycobacterium smegmatis</i> porin A (MspA) nanopore by a helicase motor for peptide sequencing application
Zhijie Chen, Zhenqin Wang, Yang Xu, et al.
Chemical Science
|
June 30, 2026
Improving the accuracy and generalizability of molecular property regression models with a substructure-substitution-rule-informed framework
Xiaoyu Fan, Lin Guo, Ruizhen Jia, et al.
Proceedings of the National Academy of Sciences of the United States of America
|
July 14, 2025
De novo design of a fusion protein tool for GPCR research
Kaixuan Gao, Xin Zhang, Jia Nie, et al.
Journal of the American Chemical Society
|
August 26, 2014
Design of reversible, cysteine-targeted Michael acceptors guided by kinetic and computational analysis
Shyam Krishnan, Rand M Miller, Boxue Tian, et al.
Biochemistry
|
August 2, 2013
Predicting enzyme-substrate specificity with QM/MM methods: a case study of the stereospecificity of (D)-glucarate dehydratase
Boxue Tian, Frank Wallrapp, Chakrapani Kalyanaraman, et al.
Page
of 4
Search research articles
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Showing results (11-20 of 35) with videos related to
Sort By:
Page
of 4
Plos Computational Biology
|
August 13, 2016
Defining the Product Chemical Space of Monoterpenoid Synthases
Boxue Tian, C Dale Poulter, Matthew P Jacobson
Trends in Biochemical Sciences
|
July 7, 2014
Leveraging structure for enzyme function prediction: methods, opportunities, and challenges
Matthew P Jacobson, Chakrapani Kalyanaraman, Suwen Zhao, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)
|
January 13, 2010
Hydroxylation and ring-opening mechanism of an unusual flavoprotein monooxygenase, 2-methyl-3-hydroxypyridine-5-carboxylic acid oxygenase: a theoretical study
Boxue Tian, Yaoquan Tu, Ake Strid, et al.
Journal of Chemical Theory and Computation
|
December 1, 2015
Can Range-Separated and Hybrid DFT Functionals Predict Low-Lying Excitations? A Tookad Case Study
Boxue Tian, Emma S E Eriksson, Leif A Eriksson
Cell Reports
|
November 27, 2025
Spring-like mechanics enable rapid inactivation and stochastic single-channel gating of the mechanically activated PIEZO channel
Wenhao Liu, Xiaochun Zhang, Qijing He, et al.
Chemical Science
|
January 10, 2022
Controlled movement of ssDNA conjugated peptide through <i>Mycobacterium smegmatis</i> porin A (MspA) nanopore by a helicase motor for peptide sequencing application
Zhijie Chen, Zhenqin Wang, Yang Xu, et al.
Chemical Science
|
June 30, 2026
Improving the accuracy and generalizability of molecular property regression models with a substructure-substitution-rule-informed framework
Xiaoyu Fan, Lin Guo, Ruizhen Jia, et al.
Proceedings of the National Academy of Sciences of the United States of America
|
July 14, 2025
De novo design of a fusion protein tool for GPCR research
Kaixuan Gao, Xin Zhang, Jia Nie, et al.
Journal of the American Chemical Society
|
August 26, 2014
Design of reversible, cysteine-targeted Michael acceptors guided by kinetic and computational analysis
Shyam Krishnan, Rand M Miller, Boxue Tian, et al.
Biochemistry
|
August 2, 2013
Predicting enzyme-substrate specificity with QM/MM methods: a case study of the stereospecificity of (D)-glucarate dehydratase
Boxue Tian, Frank Wallrapp, Chakrapani Kalyanaraman, et al.
Page
of 4