| Tumor angiogenesis: Current challenges and therapeutic opportunities FH Al-Ostoot, S Salah, HA Khamees, SA Khanum Cancer treatment and research communications 28, 100422, 2021 | 121 | 2021 |
| Synthesis, crystal structure, DFT calculations, Hirshfeld surface analysis, energy frameworks, molecular dynamics and docking studies of novel isoxazolequinoxaline derivative … N Abad, HH Sallam, FH Al-Ostoot, HA Khamees, SA Al-horaibi, ... Journal of Molecular Structure 1232, 130004, 2021 | 47 | 2021 |
| Molecular structure, DFT, vibrational spectra with fluorescence effect, hirshfeld surface, docking simulation and antioxidant activity of thiazole derivative HA Khamees, YHE Mohammed, A Swamynayaka, FH Al‐Ostoot, Y Sert, ... ChemistrySelect 4 (15), 4544-4558, 2019 | 34 | 2019 |
| Effect of o-difluoro and p-methyl substituents on the structure, optical properties and anti-inflammatory activity of phenoxy thiazole acetamide derivatives: Theoretical and … HA Khamees, YHE Mohammed, S Ananda, FH Al-Ostoot, Y Sangappa, ... Journal of Molecular Structure 1199, 127024, 2020 | 33 | 2020 |
| 5-(1-Aryl-3-(thiophen-2-yl)-1H-pyrazol-4-yl)-1H-tetrazoles: Synthesis, structural characterization, Hirshfeld analysis, anti-inflammatory and anti-bacterial studies MN Kumbar, RR Kamble, JP Dasappa, PK Bayannavar, HA Khamees, ... Journal of Molecular Structure 1160, 63-72, 2018 | 28 | 2018 |
| Synthesis, crystal structure, spectroscopic characterization, docking simulation and density functional studies of 1-(3, 4-dimethoxyphenyl)-3-(4-flurophenyl)-propan-1-one HA Khamees, M Jyothi, SA Khanum, M Madegowda Journal of Molecular Structure 1161, 199-217, 2018 | 23 | 2018 |
| Microwave-assisted synthesis, characterization, docking studies and molecular dynamic of some novel phenyl thiazole analogs as xanthine oxidase inhibitor M Jyothi, HA Khamees, SM Patil, R Ramu, SA Khanum Journal of the Iranian Chemical Society 19 (9), 3919-3933, 2022 | 21 | 2022 |
| Crystal structure, DFT calculation, Hirshfeld surface analysis and energy framework study of 6-bromo-2-(4-bromophenyl) imidazo [1, 2-a] pyridine HA Khamees, K Chaluvaiah, NA El-Khatatneh, A Swamynayaka, ... Acta Crystallographica Section E: Crystallographic Communications 75 (11 …, 2019 | 16 | 2019 |
| Structural, thermal, dielectric, nonlinear optical properties and DFT investigations of a novel material 2-(6-chloropyridin-3-yl)-N'-(2, 3-dihydro-1, 4-benzodioxin-6 … S Ananda, HA Khamees, M Mahendra, C Kumara, D Jagadeesh Prasad, ... Journal of Materials Science: Materials in Electronics 32, 14677-14702, 2021 | 14 | 2021 |
| Synthesis, analgesic, anti-inflammatory, COX/5-LOX inhibition, ulcerogenic evaluation, and docking study of benzimidazole bearing indole and benzophenone analogs KMJ Nagesh, T Prashanth, HA Khamees, SA Khanum Journal of Molecular Structure 1259, 132741, 2022 | 9 | 2022 |
| Jahn-Teller distortion in SP-like [Cu (bipy)(triamine)]. 2BF4 complexes with novel NH… F/CH… F synthon: XRD/HSA-interactions, physicochemical, electrochemical, DFT, docking … A AlAli, M Al-Noaimi, A AlObaid, HA Khamees, A Zarrouk, K Kumara, ... Journal of Molecular Liquids 387, 122689, 2023 | 7 | 2023 |
| In-silico docking, synthesis, structure analysis, DFT calculations, energy frameworks, and pharmacological intervention of [1, 3, 4]-thiadiazoles analogous as XO inhibitor and … FH Al-Ostoot, HA Khamees, N Prasad, F Zameer, SA Khanum Journal of Molecular Structure 1270, 133963, 2022 | 7 | 2022 |
| Synthesis, analgesic, anti-inflammatory, ulcerogenic evaluation, and docking study of (benzoylphenoxy)-N-{5-[2-methylphenyl-6-chlorobenzoxazole]} acetamides as COX/5-LOX inhibitor MJN Khadri, HA Khamees, S Kouser, SA Khanum Journal of Molecular Structure 1272, 134240, 2023 | 6 | 2023 |
| Third-order nonlinear optical studies of Bis (4-methylbenzylammonium) tetrachloridocuprate metal-organic crystal with optical limiting behavior: Experimental and theoretical … A Swamynayaka, MS Srinivas, V Vahini, HA Khamees, M Madegowda, ... Journal of Molecular Structure 1269, 133827, 2022 | 6 | 2022 |
| Synthesis, structure analysis, DFT calculations and energy frameworks of new coumarin appended oxadiazoles, to regress ascites malignancy by targeting VEGF mediated angiogenesis M Jyothi, A Sherapura, HA Khamees, BT Prabhakar, SA Khanum Journal of Molecular Structure 1252, 132173, 2022 | 5 | 2022 |
| Structural, Quantum Chemical and Spectroscopic Investigations on Photophysical Properties of Fluorescent Saccharide Sensor: Theoretical and Experimental Studies HA Khamees, BN Revanna, M Madegowda, J Sebastian, ... ChemistrySelect 5 (17), 5227-5238, 2020 | 5 | 2020 |
| Design, synthesis, characterization, docking studies of novel 4-phenyl acrylamide-1, 3-thiazole derivatives as anti-inflammatory and anti-ulcer agents HM Pallavi, FH Al-Ostoot, VH Kameshwar, H Khamees, SA Khanum Journal of Molecular Structure 1292, 136126, 2023 | 4 | 2023 |
| One-pot reproducible Sonosynthesis of trans-[Br (N⋂ N’) Cu (µBr) 2Cu (N⋂ N’) Br] dimer:[H…. Br S (9)] synthons, spectral, DFT/XRD/HSA, thermal, docking and novel LOX/COX … A AlAli, HA Khamees, M Madegowda, A Zarrouk, K Kumara, ... Journal of Molecular Structure 1275, 134626, 2023 | 4 | 2023 |
| Studies on New Imidazo [2, 1-b][1, 3, 4] thiadiazole Derivatives: Molecular Structure, Quantum Chemical Computational, and In silico Study of Inhibitory Activity Against Pim-1 … HA Khamees, MS Srinivas, O Nagaraja, M Madegowda, V Vahini, ... Journal of Molecular Structure 1272, 134161, 2023 | 4 | 2023 |
| Design, synthesis, docking, Hirshfeld surface analysis and DFT calculations of 2-methylxanthen-9- with the FtsZ protein from Staphylococcus aureus SAK V Lakshmi Ranganatha, Mallikarjunaswamy , Jagadeep Chandra S, Ramith ... Bioinformation 17 (3), 393-403, 2021 | 4 | 2021 |
