Kevin A Spiekermann (Kevin Spiekermann)

Publication Activity (10 Years)

Years Active: 2022-2024
Publications (10 Years): 7

Top Topics

Top Venues

Journal of the American Chemical Society

The journal of physical chemistry. A

The journal of physical chemistry. B

Scientific data

This page only lists publications with an associated author ORCID identifier.

Publications

Kevin A Spiekermann, Xiaorui Dong, Angiras Menon, William H Green, Mark Pfeifle, Frederik Sandfort, Oliver Welz, Maike Bergeler
Accurately Predicting Barrier Heights for Radical Reactions in Solution Using Deep Graph Networks. The journal of physical chemistry. A (2024)
Shih-Cheng Li, Haoyang Wu, Angiras Menon, Kevin A Spiekermann, Yi-Pei Li, William H Green
When Do Quantum Mechanical Descriptors Help Graph Neural Networks to Predict Chemical Properties? Journal of the American Chemical Society (2024)
Shih-Cheng Li, Haoyang Wu, Angiras Menon, Kevin A Spiekermann, Yi-Pei Li, William H Green
When Do Quantum Mechanical Descriptors Help Graph Neural Networks to Predict Chemical Properties? Journal of the American Chemical Society 146 (33) (2024)
Lagnajit Pattanaik, Angiras Menon, Volker Settels, Kevin A Spiekermann, Zipei Tan, Florence H Vermeire, Frederik Sandfort, Philipp Eiden, William H Green
ConfSolv: Prediction of Solute Conformer-Free Energies across a Range of Solvents. The journal of physical chemistry. B (2023)
Matthew S Johnson, Xiaorui Dong, Alon Grinberg Dana, Yunsie Chung, David Farina, Ryan J Gillis, Mengjie Liu, Nathan W Yee, Katrin Blondal, Emily J Mazeau, Colin A Grambow, A Mark Payne, Kevin A Spiekermann, Hao-Wei Pang, C Franklin Goldsmith, Richard H West, William H Green
RMG Database for Chemical Property Prediction. Journal of chemical information and modeling 62 (20) (2022)
Kevin A Spiekermann, Lagnajit Pattanaik, William H Green
High accuracy barrier heights, enthalpies, and rate coefficients for chemical reactions. Scientific data 9 (1) (2022)
Kevin A Spiekermann, Lagnajit Pattanaik, William H Green
Fast Predictions of Reaction Barrier Heights: Toward Coupled-Cluster Accuracy. The journal of physical chemistry. A 126 (25) (2022)