Your English writing platform
Discover LudwigExact(3)
In Section 2 we describe the currents considered in the spacecraft charging calculation.
The grain charge measurements are roughly matched by the charging calculation using Cassini plasma measurements.
This effect has been considered in this work for the spacecraft charging calculation (Whipple, 1981; Horányi, 1996; and references therein).
Similar(57)
For each molecule from the training set, six sets of QM charges were calculated via the above-mentioned six QM charge calculation approaches.
Unfortunately, QM charge calculation approaches are very time-consuming.
This means we used the 8 QM charge calculation approaches mentioned in Table 1 and the six QM charge calculation approaches employed for calculating our EEM parameter sets.
Values of EEM parameter sets for these six charge calculation approaches (i.e. B3LYP/6-311G/MPA,B3LYP/6-311G/NPA, B3LYP/6-311G/AIM, HF/6-311G/NPA, HF/6-311G/AIM HF/6-311G/AIMG/AIM).
Therefore, many EEM parameter sets for various QM charge calculation approaches were published later or recently (see Table 1).
EEM parameterization was performed for six QM charge calculation approaches, and a training set containing 4475 drug-like molecules was used.
Several EEM parameter sets for various types of molecules and QM charge calculation approaches have been published and new ones are still needed and produced.
Therefore, the EEM parameterizations are often performed for different QM charge calculation approaches and also for various types of molecules (small organic molecules, peptides, proteins, ligands, organometals etc).
Write better and faster with AI suggestions while staying true to your unique style.
Since I tried Ludwig back in 2017, I have been constantly using it in both editing and translation. Ever since, I suggest it to my translators at ProSciEditing.

Justyna Jupowicz-Kozak
CEO of Professional Science Editing for Scientists @ prosciediting.com