Provider: Schloss Dagstuhl - Leibniz Center for Informatics
Database: dblp computer science bibliography
Content:text/plain; charset="utf-8"
TY - JOUR
ID - DBLP:journals/ncs/AtwiCHMMR22
AU - Atwi, Rasha
AU - Chen, Ying
AU - Han, Keesung
AU - Mueller, Karl T.
AU - Murugesan, Vijayakumar
AU - Rajput, Nav Nidhi
TI - An automated framework for high-throughput predictions of NMR chemical shifts within liquid solutions.
JO - Nat. Comput. Sci.
VL - 2
IS - 2
SP - 112
EP - 122
PY - 2022//
DO - 10.1038/S43588-022-00200-9
UR - https://doi.org/10.1038/s43588-022-00200-9
ER -
TY - Informal or Other Publication
ID - DBLP:journals/corr/abs-2105-12638
AU - Panapitiya, Gihan
AU - Girard, Michael
AU - Hollas, Aaron
AU - Murugesan, Vijay
AU - Wang, Wei
AU - Saldanha, Emily
TI - Predicting Aqueous Solubility of Organic Molecules Using Deep Learning Models with Varied Molecular Representations.
JO - CoRR
VL - abs/2105.12638
PY - 2021//
UR - https://arxiv.org/abs/2105.12638
ER -
TY - Informal or Other Publication
ID - DBLP:journals/corr/abs-2106-08146
AU - Gao, Peiyuan
AU - Yang, Xiu
AU - Tang, Yu-Hang
AU - Zheng, Muqing
AU - Anderson, Amity
AU - Murugesan, Vijayakumar
AU - Hollas, Aaron
AU - Wang, Wei
TI - Graphical Gaussian Process Regression Model for Aqueous Solvation Free Energy Prediction of Organic Molecules in Redox Flow Battery.
JO - CoRR
VL - abs/2106.08146
PY - 2021//
UR - https://arxiv.org/abs/2106.08146
ER -
