Niu Huang
Orcid: 0000-0002-6912-033X
According to our database1,
Niu Huang
authored at least 14 papers
between 2003 and 2024.
Collaborative distances:
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Bibliography
2024
Structure-Based Identification of Organoruthenium Compounds as Nanomolar Antagonists of Cannabinoid Receptors.
J. Chem. Inf. Model., 2024
2022
IEEE Trans. Parallel Distributed Syst., 2022
Assessment of the Generalization Abilities of Machine-Learning Scoring Functions for Structure-Based Virtual Screening.
J. Chem. Inf. Model., 2022
2021
IEEE Access, 2021
2020
Structure-Based Optimization of 10-DEBC Derivatives as Potent and Selective Pim-1 Kinase Inhibitors.
J. Chem. Inf. Model., 2020
2019
Replacement of Protein Binding-Site Waters Contributes to Favorable Halogen Bond Interactions.
J. Chem. Inf. Model., 2019
Discovery of Novel Pim-1 Kinase Inhibitors with a Flexible-Receptor Docking Protocol.
J. Chem. Inf. Model., 2019
2015
Discovery of 2-Acylaminothiophene-3-Carboxamides as Multitarget Inhibitors for BCR-ABL Kinase and Microtubules.
J. Chem. Inf. Model., 2015
2014
Evaluation and Application of MD-PB/SA in Structure-Based Hierarchical Virtual Screening.
J. Chem. Inf. Model., 2014
2013
<i>Ab Initio</i> Modeling and Experimental Assessment of Janus Kinase 2 (JAK2) Kinase-Pseudokinase Complex Structure.
PLoS Comput. Biol., 2013
A partition function-based weighting scheme in force field parameter development using <i>ab initio</i> calculation results in global configurational space.
J. Comput. Chem., 2013
2012
Discovery of Novel Tubulin Inhibitors via Structure-Based Hierarchical Virtual Screening.
J. Chem. Inf. Model., 2012
2006
Physics-Based Scoring of Protein-Ligand Complexes: Enrichment of Known Inhibitors in Large-Scale Virtual Screening.
J. Chem. Inf. Model., 2006
2003
Consideration of Molecular Weight during Compound Selection in Virtual Target-Based Database Screening.
J. Chem. Inf. Comput. Sci., 2003