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Journal of Computational Chemistry
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August 26, 2017
Unfavorable regions in the ramachandran plot: Is it really steric hindrance? The interacting quantum atoms perspective
Peter I Maxwell, Paul L A Popelier
Physical Chemistry Chemical Physics : PCCP
|
July 27, 2017
The long-range convergence of the energetic properties of the water monomer in bulk water at room temperature
Stuart J Davie, Peter I Maxwell, Paul L A Popelier
Theoretical Chemistry Accounts
|
March 16, 2019
A relative energy gradient (REG) study of the planar and perpendicular torsional energy barriers in biphenyl
Paul L A Popelier, Peter I Maxwell, Joseph C R Thacker, et al.
Scientific Reports
|
October 11, 2017
Geometry Optimization with Machine Trained Topological Atoms
François Zielinski, Peter I Maxwell, Timothy L Fletcher, et al.
Page
of 1
Search research articles
Search
Showing results (1-10 of 4) with videos related to
Sort By:
Page
of 1
Journal of Computational Chemistry
|
August 26, 2017
Unfavorable regions in the ramachandran plot: Is it really steric hindrance? The interacting quantum atoms perspective
Peter I Maxwell, Paul L A Popelier
Physical Chemistry Chemical Physics : PCCP
|
July 27, 2017
The long-range convergence of the energetic properties of the water monomer in bulk water at room temperature
Stuart J Davie, Peter I Maxwell, Paul L A Popelier
Theoretical Chemistry Accounts
|
March 16, 2019
A relative energy gradient (REG) study of the planar and perpendicular torsional energy barriers in biphenyl
Paul L A Popelier, Peter I Maxwell, Joseph C R Thacker, et al.
Scientific Reports
|
October 11, 2017
Geometry Optimization with Machine Trained Topological Atoms
François Zielinski, Peter I Maxwell, Timothy L Fletcher, et al.
Page
of 1