Rajeev S. Assary

According to our database, Rajeev S. Assary authored at least 3 papers between 2011 and 2024.

Collaborative distances:

• Dijkstra number of four.
• Erdős number of four.

2024

<i>E</i>_min: A First-Principles Thermochemical Descriptor for Predicting Molecular Synthesizability.

Andrew S. Lee, Sarah Elliott, Hassan Harb, Logan T. Ward, Ian T. Foster, Larry A. Curtiss, Rajeev S. Assary

J. Chem. Inf. Model., February, 2024

2021

Colmena: Scalable Machine-Learning-Based Steering of Ensemble Simulations for High Performance Computing.

Logan T. Ward, Ganesh Sivaraman, J. Gregory Pauloski, Yadu N. Babuji, Ryan Chard, Naveen Dandu, Paul C. Redfern, Rajeev S. Assary, Kyle Chard, Larry A. Curtiss, Rajeev Thakur, Ian T. Foster

Proceedings of the IEEE/ACM Workshop on Machine Learning in High Performance Computing Environments, 2021

2011

A Computational Approach To Design and Evaluate Enzymatic Reaction Pathways: Application to 1-Butanol Production from Pyruvate.

Di Wu, Qin Wang, Rajeev S. Assary, Linda J. Broadbelt, Goran Krilov

J. Chem. Inf. Model., 2011