Update citation for PTMA.oplsaa.LigParGen.ff

marrink-lab · Aug 21, 2023 · 1f03941 · 1f03941
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diff --git a/polyply/data/oplsaaLigParGen/PTMA.oplsaa.LigParGen.ff b/polyply/data/oplsaaLigParGen/PTMA.oplsaa.LigParGen.ff
@@ -369,7 +369,7 @@ PTMA                  3
     21    24    1
     21    25    1
 [ citation ]
-2022RAlessandri-arXiv
+2023RAlessandri-Macromolecules
 OPLSLigParGen1
 OPLSLigParGen2
 polyply
diff --git a/polyply/data/oplsaaLigParGen/citations.bib b/polyply/data/oplsaaLigParGen/citations.bib
@@ -46,13 +46,14 @@ @article{polyply
   pages={68}
 }
 
-@article{2022RAlessandri-arXiv,
-  title={Predicting Electronic Properties of Radical-Containing Polymers at Coarse-Grained Resolutions},
+@article{2023RAlessandri-Macromolecules,
+  title={Prediction of Electronic Properties of Radical-Containing Polymers at Coarse-Grained Resolutions},
   author={Riccardo Alessandri and Juan J. de Pablo},
-  year={2022},
-  eprint={2209.02072},
-  archivePrefix={arXiv},
-  primaryClass={cond-mat.soft},
-  doi={https://doi.org/10.48550/arXiv.2209.02072} 
+  journal={Macromolecules},
+  volume={56},
+  number={10},
+  pages={3574-3584},
+  year={2023},
+  doi={10.1021/acs.macromol.3c00141}
 }