Chirag N. Patel

Orcid: 0000-0003-0777-7720

According to our database1, Chirag N. Patel authored at least 6 papers between 2017 and 2024.

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

Timeline

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PhD thesis 
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Links

On csauthors.net:

Bibliography

2024
VISH-Pred: an ensemble of fine-tuned ESM models for protein toxicity prediction.
Briefings Bioinform., 2024

2022
PharmRF: A machine-learning scoring function to identify the best protein-ligand complexes for structure-based pharmacophore screening with high enrichments.
J. Comput. Chem., 2022

Computational investigation of natural compounds as potential main protease (M<sup>pro</sup>) inhibitors for SARS-CoV-2 virus.
Comput. Biol. Medicine, 2022

2021
Identification of novel inhibitors of SARS-CoV-2 main protease (Mpro) from Withania sp. by molecular docking and molecular dynamics simulation.
J. Comput. Chem., 2021

2017
Molecular dynamics-assisted pharmacophore modeling of caspase-3-isatin sulfonamide complex: Recognizing essential intermolecular contacts and features of sulfonamide inhibitor class for caspase-3 binding.
Comput. Biol. Chem., 2017

Retrieval of promiscuous natural compounds using multiple targets docking strategy: A case study on kinase polypharmacology.
Proceedings of the 2017 IEEE International Conference on Bioinformatics and Biomedicine, 2017


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