Hafiz Saqib Ali

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Coauteurs

Sam de VisserUniversity of ManchesterAdresse e-mail validée de manchester.ac.uk
Richard HenchmanSydney Medical School, University of SydneyAdresse e-mail validée de uni.sydney.edu.au
Sumera ZaibUniversity of Central Punjab, LahoreAdresse e-mail validée de ucp.edu.pk
Yen-Ting, LinUniversity of Manchester, PhD ResearcherAdresse e-mail validée de manchester.ac.uk
Dr. Chivukula V. SastriDepartment of Chemistry, Indian Institute of Technology GuwahatiAdresse e-mail validée de iitg.ernet.in
Gourab MukherjeeDST Inspire Faculty, CSIR - Indian Institute of Chemical TechnologyAdresse e-mail validée de csiriict.in
Dr Asim ManshaGovernment College university FaisalabadAdresse e-mail validée de gcuf.edu.pk
Derren HeyesManchester Institute of Biotechnology, University of ManchesterAdresse e-mail validée de manchester.ac.uk
Muhammad Qadri Effendy MubarakLecturer, Universiti Sains Islam MalaysiaAdresse e-mail validée de usim.edu.my
Dr. Aliya IbrarAssistant Professor of ChemistryAdresse e-mail validée de uoh.edu.pk
Professor Dr. Aamer SaeedDepartment of Chemistry, Quaid-i-Azam University, Islamabad, 45320 PakistanAdresse e-mail validée de qau.edu.pk
jim warwickeruniversity of manchesterAdresse e-mail validée de manchester.ac.uk
Prof Gregory L ChallisDepartment of Chemistry, University of Warwick; Biomedicine Discovery Institute, Monash UniversityAdresse e-mail validée de warwick.ac.uk
Andrew MunroProfessor of Molecular Enzymology, University of ManchesterAdresse e-mail validée de Manchester.ac.uk
Lona AlkhalafUniversity of WarwickAdresse e-mail validée de warwick.ac.uk
Nigel ScruttonProfessor of Enzymology, Manchester Institute of Biotechnology (MIB) and School of ChemistryAdresse e-mail validée de manchester.ac.uk
jamshed iqbalDepartment of Pharmaceutical Sciences, COMSATS Institute of Information Technology AbbottabadAdresse e-mail validée de ciit.net.pk
Shafiq Ur Rahmanresearch scholarAdresse e-mail validée de ciit.net.pk
Umesh Kumar BaghaM.Sc, PhDAdresse e-mail validée de iitg.ac.in
Shahzad Zafar IqbalDepartment of Applied Chemistry, Government College University Faisalabad, PakistanAdresse e-mail validée de gcuf.edu.pk

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Hafiz Saqib Ali

The University of Oxford

Adresse e-mail validée de chem.ox.ac.uk - Page d'accueil

Computational Chemistry Physical Chemistry Organometallic Catalysis Drug Modelling Enzymatic


Titre Trier par citations Trier par année Trier par titre	Citée par Citée par	Année
Catalytic mechanism of aromatic nitration by cytochrome P450 TxtE: involvement of a ferric-peroxynitrite intermediate S Louka, SM Barry, DJ Heyes, MQE Mubarak, HS Ali, LM Alkhalaf, ... Journal of the American Chemical Society 142 (37), 15764-15779, 2020	80	2020
Local charge distributions, electric dipole moments, and local electric fields influence reactivity patterns and guide regioselectivities in α-ketoglutarate-dependent non-heme … SP De Visser, G Mukherjee, HS Ali, CV Sastri Accounts of chemical research 55 (1), 65-74, 2021	66	2021
Negative catalysis/non-Bell-Evans-Polanyi reactivity by metalloenzymes: Examples from mononuclear heme and non-heme iron oxygenases SP de Visser, YT Lin, HS Ali, UK Bagha, G Mukherjee, CV Sastri Coordination Chemistry Reviews 439, 213914, 2021	50	2021
Electrostatic perturbations in the substrate‐binding pocket of taurine/α‐ketoglutarate dioxygenase determine its selectivity HS Ali, SP de Visser Chemistry–A European Journal 28 (9), e202104167, 2022	46	2022
Lignin biodegradation by a cytochrome P450 enzyme: A computational study into syringol activation by GcoA HS Ali, RH Henchman, SP de Visser Chemistry–A European Journal 26 (57), 13093-13102, 2020	42	2020
How do electrostatic perturbations of the protein affect the bifurcation pathways of substrate hydroxylation versus desaturation in the nonheme iron-dependent viomycin … HS Ali, RH Henchman, J Warwicker, SP de Visser The Journal of Physical Chemistry A 125 (8), 1720-1737, 2021	39	2021
What determines the selectivity of arginine dihydroxylation by the nonheme iron enzyme OrfP? HS Ali, RH Henchman, SP de Visser Chemistry–A European Journal 27 (5), 1795-1809, 2021	34	2021
Cross-linking of aromatic phenolate groups by cytochrome P450 enzymes: a model for the biosynthesis of vancomycin by OxyB HS Ali, RH Henchman, SP de Visser Organic & Biomolecular Chemistry 18 (24), 4610-4618, 2020	28	2020
Electrostatic perturbations from the protein affect C− H bond strengths of the substrate and enable negative catalysis in the TmpA biosynthesis enzyme YT Lin, HS Ali, SP de Visser Chemistry–A European Journal 27 (34), 8851-8864, 2021	26	2021
How Does the Nonheme Iron Enzyme NapI React through l-Arginine Desaturation Rather Than Hydroxylation? A Quantum Mechanics/Molecular Mechanics Study HS Ali, J Warwicker, SP de Visser ACS Catalysis 13 (16), 10705-10721, 2023	24	2023
Spectroscopic, quantum chemical and molecular docking studies on 2, 4-dimethoxy-1, 3, 5-triazine: a potent inhibitor of protein kinase CK2 for the development of breast cancer drug N Akram, A Mansha, R Premkumar, AM Franklin Benial, S Asim, SZ Iqbal, ... Molecular Simulation 46 (17), 1340-1353, 2020	21	2020
A combined experimental and theoretical analysis of the solid-state supramolecular self-assembly of N-(2, 4-dichlorophenyl)-1-naphthamide: Synthesis, anticholinesterase … M Kazmi, A Ibrar, HS Ali, M Ghufran, A Wadood, U Flörke, J Simpson, ... Journal of Molecular Structure 1197, 458-470, 2019	21	2019
Entropy of simulated liquids using multiscale cell correlation HS Ali, J Higham, RH Henchman Entropy 21 (8), 750, 2019	20	2019
Mechanism of Oxidative Ring‐Closure as Part of the Hygromycin Biosynthesis Step by a Nonheme Iron Dioxygenase HS Ali, RH Henchman, SP de Visser ChemCatChem 13 (13), 3054-3066, 2021	18	2021
Energy–entropy method using multiscale cell correlation to calculate binding free energies in the SAMPL8 host–guest challenge HS Ali, A Chakravorty, J Kalayan, SP de Visser, RH Henchman Journal of computer-aided molecular design 35, 911-921, 2021	16	2021
Theoretical and computational insight into the supramolecular assemblies of Schiff bases involving hydrogen bonding and CH… π interactions: Synthesis, X-ray characterization … H Andleeb, L Danish, S Munawar, MN Ahmed, I Khan, HS Ali, MN Tahir, ... Journal of Molecular Structure 1235, 130223, 2021	15	2021
Structure-based virtual screening of dipeptidyl peptidase 4 inhibitors and their in vitro analysis SU Rahman, HS Ali, B Jafari, S Zaib, A Hameed, YMSA Al-Kahraman, ... Computational Biology and Chemistry 91, 107326, 2021	15	2021
Rhodanine-3-acetamide derivatives as aldose and aldehyde reductase inhibitors to treat diabetic complications: synthesis, biological evaluation, molecular docking and … MM Bacha, H Nadeem, S Zaib, S Sarwar, A Imran, SU Rahman, HS Ali, ... BMC chemistry 15 (1), 28, 2021	14	2021
Glutarate hydroxylation by the carbon starvation-induced protein D: A computational study into the stereo-and regioselectivities of the reaction SB Han, HS Ali, SP de Visser Inorganic Chemistry 60 (7), 4800-4815, 2021	14	2021
How external perturbations affect the chemoselectivity of substrate activation by cytochrome P450 OleT JE AS Chowdhury, HS Ali, AS Faponle, SP de Visser Physical Chemistry Chemical Physics 22 (46), 27178-27190, 2020	14	2020

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