Kyoung Tai No

Orcid: 0000-0003-3187-8193

According to our database1, Kyoung Tai No authored at least 23 papers between 1993 and 2024.

Collaborative distances:
  • Dijkstra number2 of five.
  • Erdős number3 of four.

Timeline

Legend:

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Links

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Bibliography

2024
Transformer-Based Molecular Generative Model for Antiviral Drug Design.
J. Chem. Inf. Model., 2024

2022
Prediction of polyreactive and nonspecific single-chain fragment variables through structural biochemical features and protein language-based descriptors.
BMC Bioinform., 2022

<i>De novo</i> molecular design with deep molecular generative models for PPI inhibitors.
Briefings Bioinform., 2022

2020
Development of Natural Compound Molecular Fingerprint (NC-MFP) with the Dictionary of Natural Products (DNP) for natural product-based drug development.
J. Cheminformatics, 2020

2018
Incorporation of Hydrogen Bond Angle Dependency into the Generalized Solvation Free Energy Density Model.
J. Chem. Inf. Model., 2018

Discovery of a small-molecule inhibitor of Dvl-CXXC5 interaction by computational approaches.
J. Comput. Aided Mol. Des., 2018

2017
Discovery of non-peptidic small molecule inhibitors of cyclophilin D as neuroprotective agents in Aβ-induced mitochondrial dysfunction.
J. Comput. Aided Mol. Des., 2017

In silico probing and biological evaluation of SETDB1/ESET-targeted novel compounds that reduce tri-methylated histone H3K9 (H3K9me3) level.
J. Comput. Aided Mol. Des., 2017

2016
Pharmacophore-based virtual screening, biological evaluation and binding mode analysis of a novel protease-activated receptor 2 antagonist.
J. Comput. Aided Mol. Des., 2016

2012
Development of Surface-SFED Models for Polar Solvents.
J. Chem. Inf. Model., 2012

Ligand Aligning Method for Molecular Docking: Alignment of Property-Weighted Vectors.
J. Chem. Inf. Model., 2012

2011
Calculation of the Solvation Free Energy of Neutral and Ionic Molecules in Diverse Solvents.
J. Chem. Inf. Model., 2011

2009
E<sub>a</sub>MEAD: Activation Energy Prediction of Cytochrome P450 Mediated Metabolism with Effective Atomic Descriptors.
J. Chem. Inf. Model., 2009

GEFERENCE: Reference Database for Construing Personal Genome Expression.
Proceedings of the International Conference on Bioinformatics & Computational Biology, 2009

2008
New Combined Model for the Prediction of Regioselectivity in Cytochrome P450/3A4 Mediated Metabolism.
J. Chem. Inf. Model., 2008

New Serotonin 5-HT<sub>6</sub> Ligands from Common Feature Pharmacophore Hypotheses.
J. Chem. Inf. Model., 2008

Regioselectivity Prediction of CYP1A2-Mediated Phase I Metabolism.
J. Chem. Inf. Model., 2008

2007
In silico prediction system of CYP450-mediated metabolism profile.
BMC Syst. Biol., 2007

2005
A Partition Coefficient Calculation Method with the SFED Model.
J. Chem. Inf. Model., 2005

2002
Prediction of Glass Transition Temperature (Tg) of Some Compounds in Organic Electroluminescent Devices with Their Molecular Properties.
J. Chem. Inf. Comput. Sci., 2002

1999
Development of Three-Dimensional Descriptors Represented by Tensors: Free Energy of Hydration Density Tensor.
J. Chem. Inf. Comput. Sci., 1999

1995
Determination of Net Atomics Charges Using a Modified Partial Equalization or Orbital Electronegativity Method. IC. Application to Hypervalent Sulfur and Phosphorus-Containing Molecules.
J. Comput. Chem., 1995

1993
Determination of net atomic charges using a modified partial equalization of orbital electronegativity method. III. Application to halogenated and aromatic molecules.
J. Comput. Chem., 1993


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