A database of chemical compositions of Persian medicinal herbs MH Karimi-Jafari, R Firouzi, M Ashouri, A Poursoleiman | 1 | 2022 |
A reconstructed genome‐scale metabolic model of Helicobacter pylori for predicting putative drug targets in clarithromycin and rifampicin resistance conditions S Mofidifar, A Yadegar, MH Karimi‐Jafari Helicobacter 29 (2), e13074, 2024 | | 2024 |
Adsorption behavior of Co and C2H2 on the graphite basal surface: A quantum chemistry study T Hosseinnejad, R Abdullah Mirzaei, F Nazari, MH Karimi-Jafari Journal of Structural Chemistry 54, 850-856, 2013 | 2 | 2013 |
An Ab Initio Intermolecular Potential Energy Surface for the F2 Dimer MH Karimi-Jafari, A Maghari The Journal of Physical Chemistry A 111 (27), 6077-6083, 2007 | 18 | 2007 |
An improved ab initio potential energy surface for N2–N2 MHK Jafari, A Maghari, S Shahbazian Chemical physics 314 (1-3), 249-262, 2005 | 34 | 2005 |
Application of semi-empirical quantum mechanical methods in estimation of biomolecular interactions MH Karimi-Jafari, R Firouzi, S Bagheri Nashrieh Shimi va Mohandesi Shimi Iran 41 (3), 323-344, 2022 | | 2022 |
Autoencoders in generative modeling, feature extraction, regression, and classification M Namazi, MH Karimi-Jafari, F Qassemi, JB Ghasemi Machine Learning and Pattern Recognition Methods in Chemistry from …, 2023 | | 2023 |
Binder design for targeting SARS-CoV-2 spike protein: An in silico perspective A Etemadi, HR Moradi, F Mohammadian, MH Karimi-Jafari, B Negahdari, ... Gene reports 26, 101452, 2022 | 2 | 2022 |
Biological evaluation of 9-(1H-Indol-3-yl) xanthen-4-(9H)-ones derivatives as noncompetitive α-glucosidase inhibitors: kinetics and molecular mechanisms M Nourisefat, N Salehi, S Yousefinejad, F Panahi, K Bagherzadeh, ... Structural Chemistry 30, 703-714, 2019 | 7 | 2019 |
Complexation of Sm 3+ and pamidronate: A DFT study M Arabieh, MH Khodabandeh, MH Karimi-Jafari, C Platas-Iglesias, K Zare Journal of Rare Earths 33 (3), 310-319, 2015 | 4 | 2015 |
Computational evidence of new putative allosteric sites in the acetylcholinesterase receptor B Moghadam, M Ashouri, H Roohi, MH Karimi-Jafari Journal of Molecular Graphics and Modelling 107, 107981, 2021 | 9 | 2021 |
Computational study on the structure and properties of ternary complexes of Ln3+ (Ln= La, Ce, Nd AND Sm) with 5, 7-dichloroquinoline-8-ol and 4-vinyl pyridine T Hosseinnejad, SJ Ahmadi, MH Karimi-Jafari Journal of Structural Chemistry 54 (2), 283-291, 2013 | 2 | 2013 |
Coping with the anisotropy in the analytical representation of an ab initio potential energy surface for the Cl2 dimer MH Karimi-Jafari, M Ashouri, A Yeganeh-Jabri Phys. Chem. Chem. Phys. 11 (27), 5561-5568, 2009 | 13 | 2009 |
Design of a dual-function agent by fusing a designed anti-VEGF-A binder and CPG-2 enzyme A Etemadi, MH Karimi-Jafari, B Negahdari, Y Asgari, ... Journal of Biomolecular Structure and Dynamics 41 (21), 11463-11470, 2023 | | 2023 |
Efficient construction of a diverse conformational library for amyloid-β as an intrinsically disordered protein N Salehi, M Amininasab, R Firouzi, MH Karimi-Jafari Journal of Molecular Graphics and Modelling 88, 183-193, 2019 | 8 | 2019 |
Electrostatically induced pKa shifts in oligopeptides: the upshot of neighboring side chains A Norouzy, AI Lazar, MH Karimi-Jafari, R Firouzi, WM Nau Amino Acids 54 (2), 277-287, 2022 | 5 | 2022 |
Ensemble learning from ensemble docking: Revisiting the optimum ensemble size problem S Mohammadi, Z Narimani, M Ashouri, R Firouzi, MH Karimi‐Jafari Scientific Reports 12 (1), 410, 2022 | 21 | 2022 |
ET‐score: Improving Protein‐ligand Binding Affinity Prediction Based on Distance‐weighted Interatomic Contact Features Using Extremely Randomized Trees Algorithm M Rayka, MH Karimi‐Jafari, R Firouzi Molecular Informatics 40 (8), 2060084, 2021 | 12 | 2021 |
Hersintuzumab: A novel humanized anti-HER2 monoclonal antibody induces potent tumor growth inhibition MM Amiri, F Golsaz-Shirazi, T Soltantoyeh, R Hosseini-Ghatar, ... Investigational new drugs 36 (2), 171-186, 2018 | 10 | 2018 |
Histidine substitution in the most flexible fragments of firefly luciferase modifies its thermal stability M Rahban, N Salehi, AA Saboury, S Hosseinkhani, MH Karimi-Jafari, ... Archives of biochemistry and biophysics 629, 8-18, 2017 | 13 | 2017 |