Systematic Optimization of a Fragment-Based Force Field against Experimental Pure-Liquid Properties Considering Large Compound Families: Application to Saturated Haloalkanes
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%0 Journal Article
%1 oliveira2020systematic
%A Oliveira, Marina P
%A Andrey, Maurice
%A Rieder, Salomé R
%A Kern, Leyla
%A Hahn, David F
%A Riniker, Sereina
%A Horta, Bruno AC
%A Hünenberger, Philippe H
%D 2020
%I ACS Publications
%J Journal of Chemical Theory and Computation
%K
%N 12
%P 7525--7555
%T Systematic Optimization of a Fragment-Based Force Field against Experimental Pure-Liquid Properties Considering Large Compound Families: Application to Saturated Haloalkanes
%V 16
@article{oliveira2020systematic,
added-at = {2023-08-31T14:18:50.000+0200},
author = {Oliveira, Marina P and Andrey, Maurice and Rieder, Salomé R and Kern, Leyla and Hahn, David F and Riniker, Sereina and Horta, Bruno AC and Hünenberger, Philippe H},
biburl = {https://puma.ub.uni-stuttgart.de/bibtex/2144142a2b19efa5b7d2256eabc39ac16/puma-wartung},
interhash = {d56506635ce09ffe4cb3559cbdc841ba},
intrahash = {144142a2b19efa5b7d2256eabc39ac16},
journal = {Journal of Chemical Theory and Computation},
keywords = {},
number = 12,
pages = {7525--7555},
publisher = {ACS Publications},
timestamp = {2023-08-31T12:18:50.000+0200},
title = {Systematic Optimization of a Fragment-Based Force Field against Experimental Pure-Liquid Properties Considering Large Compound Families: Application to Saturated Haloalkanes},
volume = 16,
year = 2020
}
