Projects per year
Personal profile
Expertise related to UN Sustainable Development Goals
In 2015, UN member states agreed to 17 global Sustainable Development Goals (SDGs) to end poverty, protect the planet and ensure prosperity for all. This person’s work contributes towards the following SDG(s):
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The Fingerprint is created by mining the titles and abstracts of the person's research outputs and projects/funding awards to create an index of weighted terms from discipline-specific thesauri.
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Collaborations and top research areas from the last five years
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Projects
- 4 Finished
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Biomolecular interactions and enzymatic processes
Gao, J. (PI)
NIH NIGMS NATL INST OF GENERAL
9/5/19 → 7/31/25
Project: Research project
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Simulation of Chemical Processes in Solution using Hybri
Gao, J. (PI) & Song, L. (Other Role)
THE NATIONAL SCIENCE FOUNDATION
2/1/10 → 1/31/13
Project: Research project
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A New Paradigm for Biomolecular Simulations
Gao, J. (PI) & Truhlar, D. G. (CoI)
NIH NIGMS NATL INST OF GENERAL
9/30/09 → 8/31/12
Project: Research project
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Biomolecular Interactions and Enzymatic Processes
Gao, J. (PI)
NIH NIGMS NATL INST OF GENERAL
4/1/00 → 7/31/17
Project: Research project
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Function domains and the universal matrix functional of multi-state density functional theory
Lu, Y. & Gao, J., Mar 14 2025, In: Journal of Chemical Physics. 162, 10, 104113.Research output: Contribution to journal › Article › peer-review
3 Scopus citations -
Multistate density functional theory for local and charge-transfer tripdoublet states from triplet-free radical interactions
Liu, C., Xu, Y., Bao, P., Lu, Y. & Gao, J., Jan 2025, Recent Developments of Molecular Electronic Structure Theory. Hoggan, P. E. & Coletti, C. (eds.). Academic Press Inc., p. 223-250 28 p. (Advances in Quantum Chemistry; vol. 91).Research output: Chapter in Book/Report/Conference proceeding › Chapter
1 Scopus citations -
ReaxANA: Analysis of Reactive Dynamics Trajectories for Reaction Network Generation
Zhu, H., Chen, X. & Gao, J., Aug 25 2025, In: Journal of Chemical Information and Modeling. 65, 16, p. 8549-8562 14 p.Research output: Contribution to journal › Article › peer-review
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A many-body energy decomposition analysis (MB-EDA) scheme based on a target state optimization self-consistent field (TSO-SCF) method
Tang, Z., Zhu, H., Pan, Z., Gao, J. & Zhang, J., Jun 3 2024, In: Physical Chemistry Chemical Physics. 26, 25, p. 17549-17560 12 p.Research output: Contribution to journal › Article › peer-review
1 Scopus citations -
Blueshift or redshift? Effect of hydrogen bonding interactions on the C≡N stretching frequency of 5-cyanoindole
Yang, Y., Zhao, R., Zhang, W., Gao, J. & Gai, F., Sep 28 2024, In: Journal of Chemical Physics. 161, 12, 124310.Research output: Contribution to journal › Article › peer-review
7 Scopus citations