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Journal of Chemical Theory and Computation
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June 7, 2023
Comparison of Receptor-Ligand Restraint Schemes for Alchemical Absolute Binding Free Energy Calculations
Finlay Clark, Graeme Robb, Daniel J Cole, et al.
Journal of Neurosurgery
|
March 31, 2005
Etomidate, transfusion, and vasospasm
John C Drummond, Daniel J Cole, Piyush M Patel
Biochimica Et Biophysica Acta
|
September 9, 2014
Molecular dynamics and Monte Carlo simulations for protein-ligand binding and inhibitor design
Daniel J Cole, Julian Tirado-Rives, William L Jorgensen
Scientific Reports
|
November 10, 2016
Nonlinear network model analysis of vibrational energy transfer and localisation in the Fenna-Matthews-Olson complex
Sarah E Morgan, Daniel J Cole, Alex W Chin
Photosynthesis Research
|
July 19, 2014
Constrained geometric dynamics of the Fenna-Matthews-Olson complex: the role of correlated motion in reducing uncertainty in excitation energy transfer
Alexander S Fokas, Daniel J Cole, Alex W Chin
Journal of Chemical Theory and Computation
|
November 22, 2017
Harmonic Force Constants for Molecular Mechanics Force Fields via Hessian Matrix Projection
Alice E A Allen, Michael C Payne, Daniel J Cole
Future Medicinal Chemistry
|
September 24, 2019
The future of force fields in computer-aided drug design
Daniel J Cole, Joshua T Horton, Lauren Nelson, et al.
Journal of Chemical Theory and Computation
|
September 10, 2024
Automated Adaptive Absolute Binding Free Energy Calculations
Finlay Clark, Graeme R Robb, Daniel J Cole, et al.
Anesthesia and Analgesia
|
May 18, 2022
Perioperative Brain Health in the Older Adult: A Patient Safety Imperative
Susana Vacas, Cecilia Canales, Stacie G Deiner, et al.
Chemical Communications (Cambridge, England)
|
December 19, 2019
Modelling flexible protein-ligand binding in p38α MAP kinase using the QUBE force field
Joshua T Horton, Alice E A Allen, Daniel J Cole
Page
of 10
Search research articles
Search
Showing results (21-30 of 96) with videos related to
Sort By:
Page
of 10
Journal of Chemical Theory and Computation
|
June 7, 2023
Comparison of Receptor-Ligand Restraint Schemes for Alchemical Absolute Binding Free Energy Calculations
Finlay Clark, Graeme Robb, Daniel J Cole, et al.
Journal of Neurosurgery
|
March 31, 2005
Etomidate, transfusion, and vasospasm
John C Drummond, Daniel J Cole, Piyush M Patel
Biochimica Et Biophysica Acta
|
September 9, 2014
Molecular dynamics and Monte Carlo simulations for protein-ligand binding and inhibitor design
Daniel J Cole, Julian Tirado-Rives, William L Jorgensen
Scientific Reports
|
November 10, 2016
Nonlinear network model analysis of vibrational energy transfer and localisation in the Fenna-Matthews-Olson complex
Sarah E Morgan, Daniel J Cole, Alex W Chin
Photosynthesis Research
|
July 19, 2014
Constrained geometric dynamics of the Fenna-Matthews-Olson complex: the role of correlated motion in reducing uncertainty in excitation energy transfer
Alexander S Fokas, Daniel J Cole, Alex W Chin
Journal of Chemical Theory and Computation
|
November 22, 2017
Harmonic Force Constants for Molecular Mechanics Force Fields via Hessian Matrix Projection
Alice E A Allen, Michael C Payne, Daniel J Cole
Future Medicinal Chemistry
|
September 24, 2019
The future of force fields in computer-aided drug design
Daniel J Cole, Joshua T Horton, Lauren Nelson, et al.
Journal of Chemical Theory and Computation
|
September 10, 2024
Automated Adaptive Absolute Binding Free Energy Calculations
Finlay Clark, Graeme R Robb, Daniel J Cole, et al.
Anesthesia and Analgesia
|
May 18, 2022
Perioperative Brain Health in the Older Adult: A Patient Safety Imperative
Susana Vacas, Cecilia Canales, Stacie G Deiner, et al.
Chemical Communications (Cambridge, England)
|
December 19, 2019
Modelling flexible protein-ligand binding in p38α MAP kinase using the QUBE force field
Joshua T Horton, Alice E A Allen, Daniel J Cole
Page
of 10