Projects per year
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. Our work contributes towards the following SDG(s):
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Dive into the research topics where Molecular Biophysics is active. These topic labels come from the works of this organization's members. Together they form a unique fingerprint.
Researcher collaborations from the last five years
Based on publications and projects (not datasets). Dive into details by clicking on the dots or
Profiles
Projects
- 2 Finished
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High throughput, accurate gene annotation through AI and HPC-enabled structural analysis
Skolnick, J. (PI), Cheng, J. (CoPI), Sedova, A. (CoPI) & Parks, J. (CoPI)
Biological and Environmental Research
09/15/20 → 09/14/23
Project: Research
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Multi-Scale Modeling Framework for Mercury Biogeochemistry
Smith, J. C. (PI), Parks, J. (CoPI) & Tang, G. G. (CoPI)
Biological and Environmental Research
08/15/16 → 08/14/20
Project: Research
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Accurate Machine Learning for Predicting the Viscosities of Deep Eutectic Solvents
Mohan, M., Jetti, K. D., Smith, M. D., Demerdash, O. N., Kidder, M. K. & Smith, J. C., May 14 2024, In: Journal of Chemical Theory and Computation. 20, 9, p. 3911-3926 16 p.Research output: Contribution to journal › Article › peer-review
15 Scopus citations -
Characterization of the acoustic cavitation in ionic liquids in a horn-type ultrasound reactor
Schieppati, D., Mohan, M., Blais, B., Fattahi, K., Patience, G. S., Simmons, B. A., Singh, S. & Boffito, D. C., Jan 2024, In: Ultrasonics Sonochemistry. 102, 106721.Research output: Contribution to journal › Article › peer-review
Open Access7 Scopus citations -
Deep-Learning Interatomic Potential Connects Molecular Structural Ordering to the Macroscale Properties of Polyacrylonitrile
Chahal, R., Toomey, M. D., Kearney, L. T., Sedova, A., Damron, J. T., Naskar, A. K. & Roy, S., Jul 17 2024, In: ACS Applied Materials and Interfaces. 16, 28, p. 36878-36891 14 p.Research output: Contribution to journal › Article › peer-review
Datasets
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Structural models and functional annotations for the Sphagnum divinum proteome.
Davidson, R. B. (Creator), Coletti, M. (Creator), Gao, M. (Creator) & Sedova, A. (Creator), Constellation by Oak Ridge Leadership Computing Facility (OLCF), May 31 2023
DOI: 10.13139/ORNLNCCS/1973885
Dataset
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OpenMDlr Dataset
Davidson, R. B. (Creator) & Sedova, A. (Creator), Constellation by Oak Ridge Leadership Computing Facility (OLCF), May 12 2022
DOI: 10.13139/ORNLNCCS/1866593
Dataset
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Simulation dataset for "Chemical and Morphological Structure of Transgenic Switchgrass Organosolv Lignin Extracted by Ethanol, Tetrahydrofuran, and γ-Valerolactone Pretreatments"
Mathamangalath Sethuraman, V. (Creator) & Petridis, L. (Creator), Constellation by Oak Ridge Leadership Computing Facility (OLCF), Apr 23 2021
DOI: 10.13139/ORNLNCCS/1778905
Dataset