Anton Morgunov

4PUBLICATIONS
9CO-AUTHORS
Chemical and thermal processes in energy and combustionProcess control and simulationCondensed matter modelling and density functional theoryBiomolecular modelling and design
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Publications (4)

|Jan 06, 2026
FragmentRetro: A Quadratic Retrosynthetic Method Based on Fragmentation Algorithms.

Yu Shee, Anthony M Smaldone, Anton Morgunov

|Apr 08, 2025
DirectMultiStep: Direct Route Generation for Multistep Retrosynthesis.

Yu Shee, Anton Morgunov, Haote Li

|Aug 09, 2024
MP2-Based Composite Extrapolation Schemes Can Predict Core-Ionization Energies for First-Row Elements with Coupled-Cluster Level Accuracy.

Anton Morgunov, Henry K Tran, Oinam Romesh Meitei

|Jan 30, 2024
ChemSpaceAL: An Efficient Active Learning Methodology Applied to Protein-Specific Molecular Generation.

Gregory W Kyro, Anton Morgunov, Rafael I Brent

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Frequent Collaborators

3 joint publications

Victor S Batista

2 joint publications

Gregory W Kyro

2 joint publications

Yu Shee

1 joint publications

Rafael I Brent