Results 281 to 290 of about 220,384 (307)

Molecular thermal smeared electrostatic potential

Acta Crystallographica Section A Foundations and Advances, 2018
Christian Hubschle, Sander van Smaalen
openaire   +1 more source

The antioxidant capacity of myricetin. A molecular electrostatic potential analysis based on DFT calculations

Chemical Physics Letters, 2022
Claudia Sandoval-Yañez, Jorge I Martínez-Araya   +1 more
exaly  

The preservation performance of chitosan coating with different molecular weight on strawberry using electrostatic spraying technique

International Journal of Biological Macromolecules, 2020
Yanyun Zhao, Yu Zhong
exaly  

ELECTROSTATIC MOLECULAR-POTENTIAL OF PHOSPHOLIPID LAYERS

1982
xxx
Pullman, B., Zakrzewskak, Xxxx
openaire   +1 more source

Molecular behaviour of a surfactant layer under an external electrostatic field

Journal of Molecular Liquids, 2022
Anastasia Ivanova, Chi M Phan, Alexey Cheremisin   +2 more
exaly  

Fitting Molecular Electrostatic Potentials from Quantum Mechanical Calculations

Journal of Chemical Theory and Computation, 2007
Weitao Yang
exaly  

Ab initio molecular electrostatic potentials

Theoretica Chimica Acta, 1975
Rossana Bonnaccorsi, Eolo Scrocco, Jacopo Tomasi, Alberte Pullman   +3 more
openaire   +1 more source

Influence of electrostatic field on the adsorption of phenol on single-walled carbon nanotubes: A study by molecular dynamics simulation

Chemical Engineering Journal, 2019
Yong Han
exaly  

A Comparison of Particle-Particle, Particle-Mesh and Ewald Methods for Calculating Electrostatic Interactions in Periodic Molecular Systems

Molecular Simulation, 1994
Brock A Luty, Malcolm E Davis, Wilfred F Van Gunsteren   +2 more
exaly  

Protonmotive Force: Development of Electrostatic Drivers for Synthetic Molecular Motors

Chemistry - A European Journal, 2006
James D Crowley, Ian M Steele, Brice Bosnich   +2 more
exaly