From 84db760707926b4670ffa59094802a1b4961c5e0 Mon Sep 17 00:00:00 2001 From: Shiqiang Zhang Date: Tue, 16 Apr 2024 18:33:38 +0100 Subject: [PATCH 1/2] Update README.rst Update GNN citation --- README.rst | 14 +++++++++----- 1 file changed, 9 insertions(+), 5 deletions(-) diff --git a/README.rst b/README.rst index 0303ed01..128f2d2d 100644 --- a/README.rst +++ b/README.rst @@ -48,7 +48,7 @@ When utilizing linear model decision trees, please cite the following paper in a @article{ammari2023, title={Linear Model Decision Trees as Surrogates in Optimization of Engineering Applications}, author= {Bashar L. Ammari and Emma S. Johnson and Georgia Stinchfield and Taehun Kim and Michael Bynum and William E. Hart and Joshua Pulsipher and Carl D. Laird}, - journal={Computers \& Chemical Engineering}, + journal={Computers & Chemical Engineering}, volume = {178}, year = {2023}, issn = {0098-1354}, @@ -59,11 +59,15 @@ When utilizing graph neural networks, please cite the following paper in additio :: - @article{zhang2023, - title={Augmenting optimization-based molecular design with graph neural networks}, + @article{zhang2024, + title = {Augmenting optimization-based molecular design with graph neural networks}, author= {Shiqiang Zhang and Juan S. Campos and Christian Feldmann and Frederik Sandfort and Miriam Mathea and Ruth Misener}, - journal={arXiv preprint arXiv:2312.03613}, - year = {2023}, + journal = {Computers & Chemical Engineering}, + volume = {186}, + pages = {108684}, + year = {2024}, + issn = {0098-1354}, + doi = {https://doi.org/10.1016/j.compchemeng.2024.108684}, } Documentation From 3eb2d1af3a62f7bad2804cf9514ee1ac64fc799b Mon Sep 17 00:00:00 2001 From: Shiqiang Zhang Date: Sat, 20 Apr 2024 15:45:20 +0100 Subject: [PATCH 2/2] Update README.rst --- README.rst | 4 ++-- 1 file changed, 2 insertions(+), 2 deletions(-) diff --git a/README.rst b/README.rst index 128f2d2d..e99fe927 100644 --- a/README.rst +++ b/README.rst @@ -48,7 +48,7 @@ When utilizing linear model decision trees, please cite the following paper in a @article{ammari2023, title={Linear Model Decision Trees as Surrogates in Optimization of Engineering Applications}, author= {Bashar L. Ammari and Emma S. Johnson and Georgia Stinchfield and Taehun Kim and Michael Bynum and William E. Hart and Joshua Pulsipher and Carl D. Laird}, - journal={Computers & Chemical Engineering}, + journal={Computers \& Chemical Engineering}, volume = {178}, year = {2023}, issn = {0098-1354}, @@ -62,7 +62,7 @@ When utilizing graph neural networks, please cite the following paper in additio @article{zhang2024, title = {Augmenting optimization-based molecular design with graph neural networks}, author= {Shiqiang Zhang and Juan S. Campos and Christian Feldmann and Frederik Sandfort and Miriam Mathea and Ruth Misener}, - journal = {Computers & Chemical Engineering}, + journal = {Computers \& Chemical Engineering}, volume = {186}, pages = {108684}, year = {2024},