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Biochemistry
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February 27, 2025
Targeting Bacterial RNA Polymerase: Harnessing Simulations and Machine Learning to Design Inhibitors for Drug-Resistant Pathogens
Eshani C Goonetilleke, Xuhui Huang
Nature Communications
|
August 17, 2021
Temperature-dependent kinetic pathways of heterogeneous ice nucleation competing between classical and non-classical nucleation
Chu Li, Zhuo Liu, Eshani C Goonetilleke, et al.
The Journal of Biological Chemistry
|
December 29, 2022
Nucleotide addition and cleavage by RNA polymerase II: Coordination of two catalytic reactions using a single active site
Ilona Christy Unarta, Eshani C Goonetilleke, Dong Wang, et al.
Physical Chemistry Chemical Physics : PCCP
|
September 13, 2021
Incorporation efficiency and inhibition mechanism of 2'-substituted nucleotide analogs against SARS-CoV-2 RNA-dependent RNA polymerase
Congmin Yuan, Eshani C Goonetilleke, Ilona Christy Unarta, et al.
The Journal of Physical Chemistry. B
|
November 18, 2025
A Practical Guide to Transition State Analysis in Biomolecular Simulations with TS-DAR
Eshani C Goonetilleke, Bojun Liu, Yue Wu, et al.
The Journal of Physical Chemistry. B
|
October 25, 2022
The Ion-Dipole Correction of the 3DRISM Solvation Model to Accurately Compute Water Distributions around Negatively Charged Biomolecules
Siqin Cao, Yunrui Qiu, Ilona C Unarta, et al.
JACS Au
|
October 4, 2021
Markov State Models to Study the Functional Dynamics of Proteins in the Wake of Machine Learning
Kirill A Konovalov, Ilona Christy Unarta, Siqin Cao, et al.
The Journal of Physical Chemistry. B
|
February 28, 2024
Submillisecond Atomistic Molecular Dynamics Simulations Reveal Hydrogen Bond-Driven Diffusion of a Guest Peptide in Protein-RNA Condensate
Ilona C Unarta, Siqin Cao, Eshani C Goonetilleke, et al.
The Journal of Biological Chemistry
|
May 15, 2021
A comprehensive mechanism for 5-carboxylcytosine-induced transcriptional pausing revealed by Markov state models
Kirill A Konovalov, Wei Wang, Guo Wang, et al.
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of 1
Search research articles
Search
Showing results (1-10 of 9) with videos related to
Sort By:
Page
of 1
Biochemistry
|
February 27, 2025
Targeting Bacterial RNA Polymerase: Harnessing Simulations and Machine Learning to Design Inhibitors for Drug-Resistant Pathogens
Eshani C Goonetilleke, Xuhui Huang
Nature Communications
|
August 17, 2021
Temperature-dependent kinetic pathways of heterogeneous ice nucleation competing between classical and non-classical nucleation
Chu Li, Zhuo Liu, Eshani C Goonetilleke, et al.
The Journal of Biological Chemistry
|
December 29, 2022
Nucleotide addition and cleavage by RNA polymerase II: Coordination of two catalytic reactions using a single active site
Ilona Christy Unarta, Eshani C Goonetilleke, Dong Wang, et al.
Physical Chemistry Chemical Physics : PCCP
|
September 13, 2021
Incorporation efficiency and inhibition mechanism of 2'-substituted nucleotide analogs against SARS-CoV-2 RNA-dependent RNA polymerase
Congmin Yuan, Eshani C Goonetilleke, Ilona Christy Unarta, et al.
The Journal of Physical Chemistry. B
|
November 18, 2025
A Practical Guide to Transition State Analysis in Biomolecular Simulations with TS-DAR
Eshani C Goonetilleke, Bojun Liu, Yue Wu, et al.
The Journal of Physical Chemistry. B
|
October 25, 2022
The Ion-Dipole Correction of the 3DRISM Solvation Model to Accurately Compute Water Distributions around Negatively Charged Biomolecules
Siqin Cao, Yunrui Qiu, Ilona C Unarta, et al.
JACS Au
|
October 4, 2021
Markov State Models to Study the Functional Dynamics of Proteins in the Wake of Machine Learning
Kirill A Konovalov, Ilona Christy Unarta, Siqin Cao, et al.
The Journal of Physical Chemistry. B
|
February 28, 2024
Submillisecond Atomistic Molecular Dynamics Simulations Reveal Hydrogen Bond-Driven Diffusion of a Guest Peptide in Protein-RNA Condensate
Ilona C Unarta, Siqin Cao, Eshani C Goonetilleke, et al.
The Journal of Biological Chemistry
|
May 15, 2021
A comprehensive mechanism for 5-carboxylcytosine-induced transcriptional pausing revealed by Markov state models
Kirill A Konovalov, Wei Wang, Guo Wang, et al.
Page
of 1