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Plos One
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August 21, 2019
Hidden bias in the DUD-E dataset leads to misleading performance of deep learning in structure-based virtual screening
Lieyang Chen, Anthony Cruz, Steven Ramsey, et al.
Physical Chemistry Chemical Physics : PCCP
|
April 2, 2016
Simulation of lipid bilayer self-assembly using all-atom lipid force fields
Åge A Skjevik, Benjamin D Madej, Callum J Dickson, et al.
Journal of Computer-Aided Molecular Design
|
May 1, 2024
Reactivities of acrylamide warheads toward cysteine targets: a QM/ML approach to covalent inhibitor design
Aaron D Danilack, Callum J Dickson, Cihan Soylu, et al.
Journal of Chemical Theory and Computation
|
May 8, 2014
Lipid14: The Amber Lipid Force Field
Callum J Dickson, Benjamin D Madej, Age A Skjevik, et al.
Structure (London, England : 1993)
|
August 24, 2024
Scorpion α-toxin LqhαIT specifically interacts with a glycan at the pore domain of voltage-gated sodium channels
Swastik Phulera, Callum J Dickson, Christopher J Schwalen, et al.
Chemical Communications (Cambridge, England)
|
November 4, 2016
Imaging plasma membrane phase behaviour in live cells using a thiophene-based molecular rotor
Michael R Dent, Ismael López-Duarte, Callum J Dickson, et al.
Journal of Chemical Theory and Computation
|
February 23, 2022
Combined Free-Energy Calculation and Machine Learning Methods for Understanding Ligand Unbinding Kinetics
Magd Badaoui, Pedro J Buigues, Dénes Berta, et al.
Physical Chemistry Chemical Physics : PCCP
|
June 25, 2015
Imaging phase separation in model lipid membranes through the use of BODIPY based molecular rotors
Michael R Dent, Ismael López-Duarte, Callum J Dickson, et al.
Journal of Medicinal Chemistry
|
May 31, 2016
Uncoupling the Structure-Activity Relationships of β2 Adrenergic Receptor Ligands from Membrane Binding
Callum J Dickson, Viktor Hornak, Camilo Velez-Vega, et al.
RSC Chemical Biology
|
December 12, 2024
Dynamic conformational equilibria in the active states of KRAS and NRAS
Enrico Rennella, Chrystèle Henry, Callum J Dickson, et al.
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of 3
Search research articles
Search
Showing results (11-20 of 25) with videos related to
Sort By:
Page
of 3
Plos One
|
August 21, 2019
Hidden bias in the DUD-E dataset leads to misleading performance of deep learning in structure-based virtual screening
Lieyang Chen, Anthony Cruz, Steven Ramsey, et al.
Physical Chemistry Chemical Physics : PCCP
|
April 2, 2016
Simulation of lipid bilayer self-assembly using all-atom lipid force fields
Åge A Skjevik, Benjamin D Madej, Callum J Dickson, et al.
Journal of Computer-Aided Molecular Design
|
May 1, 2024
Reactivities of acrylamide warheads toward cysteine targets: a QM/ML approach to covalent inhibitor design
Aaron D Danilack, Callum J Dickson, Cihan Soylu, et al.
Journal of Chemical Theory and Computation
|
May 8, 2014
Lipid14: The Amber Lipid Force Field
Callum J Dickson, Benjamin D Madej, Age A Skjevik, et al.
Structure (London, England : 1993)
|
August 24, 2024
Scorpion α-toxin LqhαIT specifically interacts with a glycan at the pore domain of voltage-gated sodium channels
Swastik Phulera, Callum J Dickson, Christopher J Schwalen, et al.
Chemical Communications (Cambridge, England)
|
November 4, 2016
Imaging plasma membrane phase behaviour in live cells using a thiophene-based molecular rotor
Michael R Dent, Ismael López-Duarte, Callum J Dickson, et al.
Journal of Chemical Theory and Computation
|
February 23, 2022
Combined Free-Energy Calculation and Machine Learning Methods for Understanding Ligand Unbinding Kinetics
Magd Badaoui, Pedro J Buigues, Dénes Berta, et al.
Physical Chemistry Chemical Physics : PCCP
|
June 25, 2015
Imaging phase separation in model lipid membranes through the use of BODIPY based molecular rotors
Michael R Dent, Ismael López-Duarte, Callum J Dickson, et al.
Journal of Medicinal Chemistry
|
May 31, 2016
Uncoupling the Structure-Activity Relationships of β2 Adrenergic Receptor Ligands from Membrane Binding
Callum J Dickson, Viktor Hornak, Camilo Velez-Vega, et al.
RSC Chemical Biology
|
December 12, 2024
Dynamic conformational equilibria in the active states of KRAS and NRAS
Enrico Rennella, Chrystèle Henry, Callum J Dickson, et al.
Page
of 3