Year |
Citation |
Score |
2022 |
Dommer A, Casalino L, Kearns F, Rosenfeld M, Wauer N, Ahn SH, Russo J, Oliveira S, Morris C, Bogetti A, Trifan A, Brace A, Sztain T, Clyde A, Ma H, ... ... Qiao Z, et al. #COVIDisAirborne: AI-enabled multiscale computational microscopy of delta SARS-CoV-2 in a respiratory aerosol. The International Journal of High Performance Computing Applications. 37: 28-44. PMID 36647365 DOI: 10.1177/10943420221128233 |
0.455 |
|
2022 |
Qiao Z, Christensen AS, Welborn M, Manby FR, Anandkumar A, Miller TF. Informing geometric deep learning with electronic interactions to accelerate quantum chemistry. Proceedings of the National Academy of Sciences of the United States of America. 119: e2205221119. PMID 35901215 DOI: 10.1073/pnas.2205221119 |
0.445 |
|
2021 |
Christensen AS, Sirumalla SK, Qiao Z, O'Connor MB, Smith DGA, Ding F, Bygrave PJ, Anandkumar A, Welborn M, Manby FR, Miller TF. OrbNet Denali: A machine learning potential for biological and organic chemistry with semi-empirical cost and DFT accuracy. The Journal of Chemical Physics. 155: 204103. PMID 34852495 DOI: 10.1063/5.0061990 |
0.438 |
|
2021 |
Dommer A, Casalino L, Kearns F, Rosenfeld M, Wauer N, Ahn SH, Russo J, Oliveira S, Morris C, Bogetti A, Trifan A, Brace A, Sztain T, Clyde A, Ma H, ... ... Qiao Z, et al. #COVIDisAirborne: AI-Enabled Multiscale Computational Microscopy of Delta SARS-CoV-2 in a Respiratory Aerosol. Biorxiv : the Preprint Server For Biology. PMID 34816263 DOI: 10.1101/2021.11.12.468428 |
0.455 |
|
2020 |
Qiao Z, Welborn M, Anandkumar A, Manby FR, Miller TF. OrbNet: Deep learning for quantum chemistry using symmetry-adapted atomic-orbital features. The Journal of Chemical Physics. 153: 124111. PMID 33003742 DOI: 10.1063/5.0021955 |
0.445 |
|
2019 |
Qiao Z, Zhao Y, Gao YQ. Ice Nucleation of Confined Monolayer Water Conforms to Classical Nucleation Theory. The Journal of Physical Chemistry Letters. 3115-3121. PMID 31117689 DOI: 10.1021/Acs.Jpclett.9B01169 |
0.467 |
|
2019 |
Cai X, Xie WJ, Yang Y, Long Z, Zhang J, Qiao Z, Yang L, Gao YQ. Structure of water confined between two parallel graphene plates. The Journal of Chemical Physics. 150: 124703. PMID 30927866 DOI: 10.1063/1.5080788 |
0.455 |
|
2019 |
Qiao Z, Xie WJ, Cai X, Gao YQ. Interlayer hopping dynamics of bilayer water confined between graphene sheets Chemical Physics Letters. 722: 153-159. DOI: 10.1016/J.Cplett.2019.02.046 |
0.482 |
|
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