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Current Medicinal Chemistry
|
April 10, 2019
Ligand- and Structure-Based Drug Design and Optimization using KNIME
Michael P Mazanetz, Charlotte H F Goode, Ewa I Chudyk
Biochemical Society Transactions
|
April 13, 2016
Using the fragment molecular orbital method to investigate agonist-orexin-2 receptor interactions
Alexander Heifetz, Matteo Aldeghi, Ewa I Chudyk, et al.
Journal of the American Chemical Society
|
October 4, 2012
The basis for carbapenem hydrolysis by class A β-lactamases: a combined investigation using crystallography and simulations
Fátima Fonseca, Ewa I Chudyk, Marc W van der Kamp, et al.
Chemical Communications (Cambridge, England)
|
October 17, 2014
QM/MM simulations as an assay for carbapenemase activity in class A β-lactamases
Ewa I Chudyk, Michael A L Limb, Charlotte Jones, et al.
Journal of Chemical Information and Modeling
|
December 8, 2015
The Fragment Molecular Orbital Method Reveals New Insight into the Chemical Nature of GPCR-Ligand Interactions
Alexander Heifetz, Ewa I Chudyk, Laura Gleave, et al.
The Journal of Physical Chemistry. B
|
May 10, 2013
Nonempirical energetic analysis of reactivity and covalent inhibition of fatty acid amide hydrolase
Ewa I Chudyk, Edyta Dyguda-Kazimierowicz, Karol M Langner, et al.
ACS Infectious Diseases
|
July 25, 2022
QM/MM Simulations Reveal the Determinants of Carbapenemase Activity in Class A β-Lactamases
Ewa I Chudyk, Michael Beer, Michael A L Limb, et al.
Journal of Chemical Information and Modeling
|
July 31, 2019
An Efficient Computational Assay for β-Lactam Antibiotic Breakdown by Class A β-Lactamases
Viivi H A Hirvonen, Katharine Hammond, Ewa I Chudyk, et al.
Methods in Molecular Biology (Clifton, N.J.)
|
December 1, 2017
Exploring GPCR-Ligand Interactions with the Fragment Molecular Orbital (FMO) Method
Ewa I Chudyk, Laurie Sarrat, Matteo Aldeghi, et al.
Journal of Medicinal Chemistry
|
March 8, 2016
Fragment Molecular Orbital Method Applied to Lead Optimization of Novel Interleukin-2 Inducible T-Cell Kinase (ITK) Inhibitors
Alexander Heifetz, Giancarlo Trani, Matteo Aldeghi, et al.
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of 1
Search research articles
Search
Showing results (1-10 of 10) with videos related to
Sort By:
Page
of 1
Current Medicinal Chemistry
|
April 10, 2019
Ligand- and Structure-Based Drug Design and Optimization using KNIME
Michael P Mazanetz, Charlotte H F Goode, Ewa I Chudyk
Biochemical Society Transactions
|
April 13, 2016
Using the fragment molecular orbital method to investigate agonist-orexin-2 receptor interactions
Alexander Heifetz, Matteo Aldeghi, Ewa I Chudyk, et al.
Journal of the American Chemical Society
|
October 4, 2012
The basis for carbapenem hydrolysis by class A β-lactamases: a combined investigation using crystallography and simulations
Fátima Fonseca, Ewa I Chudyk, Marc W van der Kamp, et al.
Chemical Communications (Cambridge, England)
|
October 17, 2014
QM/MM simulations as an assay for carbapenemase activity in class A β-lactamases
Ewa I Chudyk, Michael A L Limb, Charlotte Jones, et al.
Journal of Chemical Information and Modeling
|
December 8, 2015
The Fragment Molecular Orbital Method Reveals New Insight into the Chemical Nature of GPCR-Ligand Interactions
Alexander Heifetz, Ewa I Chudyk, Laura Gleave, et al.
The Journal of Physical Chemistry. B
|
May 10, 2013
Nonempirical energetic analysis of reactivity and covalent inhibition of fatty acid amide hydrolase
Ewa I Chudyk, Edyta Dyguda-Kazimierowicz, Karol M Langner, et al.
ACS Infectious Diseases
|
July 25, 2022
QM/MM Simulations Reveal the Determinants of Carbapenemase Activity in Class A β-Lactamases
Ewa I Chudyk, Michael Beer, Michael A L Limb, et al.
Journal of Chemical Information and Modeling
|
July 31, 2019
An Efficient Computational Assay for β-Lactam Antibiotic Breakdown by Class A β-Lactamases
Viivi H A Hirvonen, Katharine Hammond, Ewa I Chudyk, et al.
Methods in Molecular Biology (Clifton, N.J.)
|
December 1, 2017
Exploring GPCR-Ligand Interactions with the Fragment Molecular Orbital (FMO) Method
Ewa I Chudyk, Laurie Sarrat, Matteo Aldeghi, et al.
Journal of Medicinal Chemistry
|
March 8, 2016
Fragment Molecular Orbital Method Applied to Lead Optimization of Novel Interleukin-2 Inducible T-Cell Kinase (ITK) Inhibitors
Alexander Heifetz, Giancarlo Trani, Matteo Aldeghi, et al.
Page
of 1