Art E Cho

13PUBLICATIONS
28CO-AUTHORS
Bioinformatic methods developmentBiomolecular modelling and designMain group metal chemistryTheoretical quantum chemistryHuman impacts of climate change and human adaptation
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Publications (13)

|May 30, 2025
Enhancing binding affinity predictions through efficient sampling with a re-engineered BAR method: a test on GPCR targets.

Minkyu Kim, Jian Jeong, Donghwan Kim

|Oct 29, 2024
Accurate protein-ligand binding free energy estimation using QM/MM on multi-conformers predicted from classical mining minima.

Farzad Molani, Art E Cho

|Jun 10, 2024
Photocatalytic Conversion of CO2 to Formate/CO by an (η6-para-Cymene)Ru(II) Half-Metallocene Catalyst: Influence of Additives and TiO2 Immobilization on the Catalytic Mechanism and Product Selectivity.

Daehan Lee, Farzad Molani, Min Su Choe

|Jan 16, 2024
Correction to "Combining QM/MM Calculations with Classical Mining Minima to Predict Protein-Ligand Binding Free Energy".

Farzad Molani, Simon Webb, Art E Cho

|Nov 27, 2023
Elucidating TH301's influence on the torsion angle of CRY1 W399 using replica exchange with solute tempering (REST) molecular dynamics (MD) simulations.

Yeongrae Cho, Kexin Li, Jin Hyup Lee

|Apr 20, 2023
Combining QM/MM Calculations with Classical Mining Minima to Predict Protein-Ligand Binding Free Energy.

Farzad Molani, Simon Webb, Art E Cho

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Frequent Collaborators

3 joint publications

Yongmin Chang

3 joint publications

Farzad Molani

2 joint publications

Ji-Ae Park

2 joint publications

Simon Webb