Title : Reverse Monte Carlo modeling of liquid water with the explicit use of the SPC/E interatomic potential.

Pub. Date : 2017 Feb 14

PMID : 28201892






3 Functional Relationships(s)
Download
Sentence
Compound Name
Protein Name
Organism
1 Reverse Monte Carlo modeling of liquid water with the explicit use of the SPC/E interatomic potential. Water proline rich protein gene cluster Homo sapiens
2 Reverse Monte Carlo (RMC) modeling of liquid water, based on one neutron and one X-ray diffraction data set, applying also the most popular interatomic potential for water, extended simple point charge (SPC/E), has been performed. Water proline rich protein gene cluster Homo sapiens
3 The strictly rigid geometry of SPC/E water molecules had to be loosened somewhat, in order to be able to produce a good fit to both sets of experimental data. Water proline rich protein gene cluster Homo sapiens