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Proteins
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February 4, 2022
Structural insights into the substrate-binding site of main protease for the structure-based COVID-19 drug discovery
Rohoullah Firouzi, Mitra Ashouri, Mohammad Hossein Karimi-Jafari
Journal of Biomolecular Structure & Dynamics
|
January 2, 2024
Improving protein-ligand docking results using the Semiempirical quantum mechanics: testing on the PDBbind 2016 core set
Zainab Mohebbinia, Rohoullah Firouzi, Mohammad Hossein Karimi-Jafari
Molecular Informatics
|
May 22, 2021
ET-score: Improving Protein-ligand Binding Affinity Prediction Based on Distance-weighted Interatomic Contact Features Using Extremely Randomized Trees Algorithm
Milad Rayka, Mohammad Hossein Karimi-Jafari, Rohoullah Firouzi
Helicobacter
|
April 14, 2024
A reconstructed genome-scale metabolic model of Helicobacter pylori for predicting putative drug targets in clarithromycin and rifampicin resistance conditions
Sepideh Mofidifar, Abbas Yadegar, Mohammad Hossein Karimi-Jafari
Journal of Molecular Modeling
|
September 4, 2012
Low-energy conformers of pamidronate and their intramolecular hydrogen bonds: a DFT and QTAIM study
Masoud Arabieh, Mohammad Hossein Karimi-Jafari, Mohammad Ghannadi-Maragheh
Journal of Molecular Graphics & Modelling
|
February 2, 2019
Efficient construction of a diverse conformational library for amyloid-β as an intrinsically disordered protein
Najmeh Salehi, Mehriar Amininasab, Rohoullah Firouzi, et al.
Scientific Reports
|
April 12, 2020
iMM1865: A New Reconstruction of Mouse Genome-Scale Metabolic Model
Saeideh Khodaee, Yazdan Asgari, Mehdi Totonchi, et al.
Molecular Informatics
|
June 3, 2020
Using the Semiempirical Quantum Mechanics in Improving the Molecular Docking: A Case Study with CDK2
Saleh Bagheri, Hassan Behnejad, Rohoullah Firouzi, et al.
BMC Bioinformatics
|
November 11, 2021
Prediction of antimicrobial peptides toxicity based on their physico-chemical properties using machine learning techniques
Hossein Khabbaz, Mohammad Hossein Karimi-Jafari, Ali Akbar Saboury, et al.
Scientific Reports
|
September 28, 2021
Integration and gene co-expression network analysis of scRNA-seq transcriptomes reveal heterogeneity and key functional genes in human spermatogenesis
Najmeh Salehi, Mohammad Hossein Karimi-Jafari, Mehdi Totonchi, et al.
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Search research articles
Search
Showing results (1-10 of 27) with videos related to
Sort By:
Page
of 3
Proteins
|
February 4, 2022
Structural insights into the substrate-binding site of main protease for the structure-based COVID-19 drug discovery
Rohoullah Firouzi, Mitra Ashouri, Mohammad Hossein Karimi-Jafari
Journal of Biomolecular Structure & Dynamics
|
January 2, 2024
Improving protein-ligand docking results using the Semiempirical quantum mechanics: testing on the PDBbind 2016 core set
Zainab Mohebbinia, Rohoullah Firouzi, Mohammad Hossein Karimi-Jafari
Molecular Informatics
|
May 22, 2021
ET-score: Improving Protein-ligand Binding Affinity Prediction Based on Distance-weighted Interatomic Contact Features Using Extremely Randomized Trees Algorithm
Milad Rayka, Mohammad Hossein Karimi-Jafari, Rohoullah Firouzi
Helicobacter
|
April 14, 2024
A reconstructed genome-scale metabolic model of Helicobacter pylori for predicting putative drug targets in clarithromycin and rifampicin resistance conditions
Sepideh Mofidifar, Abbas Yadegar, Mohammad Hossein Karimi-Jafari
Journal of Molecular Modeling
|
September 4, 2012
Low-energy conformers of pamidronate and their intramolecular hydrogen bonds: a DFT and QTAIM study
Masoud Arabieh, Mohammad Hossein Karimi-Jafari, Mohammad Ghannadi-Maragheh
Journal of Molecular Graphics & Modelling
|
February 2, 2019
Efficient construction of a diverse conformational library for amyloid-β as an intrinsically disordered protein
Najmeh Salehi, Mehriar Amininasab, Rohoullah Firouzi, et al.
Scientific Reports
|
April 12, 2020
iMM1865: A New Reconstruction of Mouse Genome-Scale Metabolic Model
Saeideh Khodaee, Yazdan Asgari, Mehdi Totonchi, et al.
Molecular Informatics
|
June 3, 2020
Using the Semiempirical Quantum Mechanics in Improving the Molecular Docking: A Case Study with CDK2
Saleh Bagheri, Hassan Behnejad, Rohoullah Firouzi, et al.
BMC Bioinformatics
|
November 11, 2021
Prediction of antimicrobial peptides toxicity based on their physico-chemical properties using machine learning techniques
Hossein Khabbaz, Mohammad Hossein Karimi-Jafari, Ali Akbar Saboury, et al.
Scientific Reports
|
September 28, 2021
Integration and gene co-expression network analysis of scRNA-seq transcriptomes reveal heterogeneity and key functional genes in human spermatogenesis
Najmeh Salehi, Mohammad Hossein Karimi-Jafari, Mehdi Totonchi, et al.
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