New paper coming, and new peer review

espottesmith · Oct 27, 2024 · 5754d70 · 5754d70
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diff --git a/_pages/cv.md b/_pages/cv.md
@@ -93,7 +93,7 @@ Resources and Funding
 Contributed Reviews
 ======
 
-* 2024: The Journal of Open Source Software (x2), Scientific Data, Digital Discovery, Journal of Physics D: Applied Physics, Journal of Chemical Theory and Computation
+* 2024: The Journal of Open Source Software (x2), Scientific Data, Digital Discovery, Journal of Physics D: Applied Physics, Journal of Chemical Theory and Computation, Journal of Chemical Information and Modeling, Chemical Science
 * 2023: ACS Nano, Journal of Chemical Information and Modeling, npj Computational Materials
 * 2022: ACS Energy Letters, The Journal of Open Source Software
 

diff --git a/_pages/publications.md b/_pages/publications.md
@@ -39,6 +39,26 @@ author_profile: true
 			<span class="date">
 				
 				
+			</span>
+		</td>
+		<td class="publication">
+			<span class="pubtitle">
+				HEPOM: Using Graph Neural Networks for the accelerated predictions of Hydrolysis Free Energies in different pH conditions.
+			</span><br />
+			<span class="authors">
+				Rishabh D.  Guha*, Santiago   Vargas*, <b>Evan Walter Clark  Spotte-Smith</b>, Alexander Rizzolo  Epstein, Maxwell   Venetos, Ryan   Kingsbury, Mingjian   Wen, Samuel M.  Blau, and Kristin A.  Persson.
+			</span><br />
+			<span class="venuetype"></span><span class="venue">In preparation</span>.
+			<br />
+			<span class="links">
+			</span>
+		</td>
+	</tr>
+	<tr>
+		<td>
+			<span class="date">
+				
+				
 			</span>
 		</td>
 		<td class="publication">

diff --git a/files/bib/publications.bib b/files/bib/publications.bib
@@ -5,6 +5,13 @@ @article{sivonxay202401
   year={2024},
 }
 
+@article{guha202401,
+  title={{HEPOM}: Using Graph Neural Networks for the accelerated predictions of Hydrolysis Free Energies in different {pH} conditions},
+  author={Guha*, Rishabh D. and Vargas*, Santiago and Spotte-Smith, Evan Walter Clark and Epstein, Alexander Rizzolo and Venetos, Maxwell and Kingsbury, Ryan and Wen, Mingjian and Blau, Samuel M. and Persson, Kristin A.},
+  journal={In preparation},
+  year={2024},
+}
+
 @article{spottesmith202401,
   title={Calculated Properties of Molecules at Diverse Charge and Spin States for Next-Generation Chemical Machine Learning},
   author={Spotte-Smith, Evan Walter Clark and Hegazy, Kareem and Avaylon, Matthew and Vargas, Santiago and Cohen, Orion and Mahoney, Michael W. and Perciano, Talita and Persson, Kristin A. and Blau, Samuel M.},

diff --git a/files/evan_spotte-smith_cv.pdf b/files/evan_spotte-smith_cv.pdf