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Rana Rehan Khalid
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Computational screening of medicinal plant phytochemicals to discover potent pan-serotype inhibitors against dengue virus
M Tahir ul Qamar, A Maryam, I Muneer, F Xing, UA Ashfaq, FA Khan, ...
Scientific reports 9 (1), 1433, 2019
1082019
The molecular organization of human cGMP specific phosphodiesterase 6 (PDE6): structural implications of somatic mutations in cancer and retinitis pigmentosa
A Maryam, SC Vedithi, RR Khalid, AF Alsulami, PHM Torres, AR Siddiqi, ...
Computational and structural biotechnology journal 17, 378-389, 2019
222019
Comparative studies of the dynamics effects of BAY60-2770 and BAY58-2667 binding with human and bacterial H-NOX domains
RR Khalid, MT ul Qamar, A Maryam, A Ashique, F Anwar, MH Geesi, ...
Molecules: A Journal of Synthetic Chemistry and Natural Product Chemistry 23 (9), 2018
192018
E-pharmacophore based virtual screening for identification of dual specific PDE5A and PDE3A inhibitors as potential leads against cardiovascular diseases
A Maryam, RR Khalid, AR Siddiqi, A Ece
Journal of Biomolecular Structure and Dynamics 39 (7), 2302-2317, 2021
142021
Decreased serum PON1 arylesterase activity in familial hypercholesterolemia patients with a mutated LDLR gene
M Idrees, AR Siddiqi, M Ajmal, M Akram, RR Khalid, A Hussain, R Qamar, ...
Genetics and Molecular Biology 41, 570-577, 2018
132018
Statistical analysis of risk factors affecting the prognosis of biliary atresia in infants
A Maryam, S Aslam, S Saif, T Aslam, K Tusleem, MT Qamar, I Abdullah, ...
Matrix Science Pharma 1 (2), 20-24, 2017
122017
Design, synthesis, characterization and computational docking studies of novel sulfonamide derivatives
H Saleem, A Maryam, SA Bokhari, A Ashiq, SA Rauf, RR Khalid, ...
EXCLI journal 17, 169, 2018
112018
Probing the structural dynamics of the catalytic domain of human soluble guanylate cyclase
RR Khalid, A Maryam, OU Sezerman, E Mylonas, AR Siddiqi, ...
Scientific reports 10 (1), 9488, 2020
92020
Exploring the structural basis of conformational heterogeneity and autoinhibition of human cGMP-specific protein kinase Iα through computational modelling and molecular …
A Maryam, RR Khalid, SC Vedithi, ECE Abdulilah, SS Çınaroğlu, ...
Computational and Structural Biotechnology Journal 18, 1625-1638, 2020
92020
Cryo-EM density map fitting driven in-silico structure of human soluble guanylate cyclase (hsGC) reveals functional aspects of inter-domain cross talk upon NO binding
RR Khalid, A Maryam, VE Fadouloglou, AR Siddiqi, Y Zhang
Journal of Molecular Graphics and Modelling 90, 109-119, 2019
82019
A three-dimensional active biochar for sintering in steel industry and remove methylene blue by synergistic activation of H3PO4 and ZnCl2
Y Zhang, B Shen, MS Ahmad, W Zhou, RR Khalid, M Ibrahim, A Bokhari
Fuel 336, 127079, 2023
72023
Tahir ul Qamar M., Maryam A., Ashique A., Anwar FH, Geesi M., Siddiqi AR Comparative Studies of the Dynamics Effects of BAY60-2770 and BAY58-2667 Binding with Human and …
R Rehan Khalid
Molecules 23 (2141), 10.3390, 2018
72018
Dynamic characterization of the human heme nitric oxide/oxygen (HNOX) domain under the influence of diatomic gaseous ligands
RR Khalid, AR Siddiqi, E Mylonas, A Maryam, M Kokkinidis
International journal of molecular sciences 20 (3), 698, 2019
62019
Effect of nickel on different physiological parameters of Raphanus sativus
H Rafeeq, MA Arshad, SF Amjad, MH Ullah, HM Imran, R Khalid, ...
Int J Sci Res Publ 10, 9702, 2020
52020
Development of a tool for the analysis of plant stress proteins
M Ali, RR Khalid, M Nawaz, N Qamar
International Journal Bioautomation 15 (4), 261, 2011
32011
Identification of selective inhibitors for phosphodiesterase 5A using e-pharmacophore modelling and large-scale virtual screening-based structure guided drug discovery approaches
A Maryam, AR Siddiqi, S Chaitanya Vedithi, A Ece, RR Khalid
Journal of Biomolecular Structure and Dynamics, 1-16, 2023
22023
Functional annotation of the cda1 gene from Bacillus thuringiensis through homology modeling and molecular docking
M Ali, MA Mehmood, K Hussain, U Sehar, RR Khalid, Z Iqbal
Pak. J. Life Soc. Sci 11, 190-195, 2013
22013
A recursive molecular docking coupled with energy-based pose-rescoring and MD simulations to identify hsGC βH-NOX allosteric modulators for cardiovascular …
RR Khalid, A Maryam, SS Çınaroğlu, AR Siddiqi, OU Sezerman
Journal of Biomolecular Structure and Dynamics 40 (13), 6128-6150, 2022
12022
Physicochemical Characterization and Antioxidant Activity of Extract of Epimedium Grandiflorum
N ASIF, S AMJAD, K HUSSAIN, M SALMAN, F QURESHI, NI BUKHARI, ...
Journal of Pharmacy and Chemistry, 2016
12016
Leveraging Shape Screening and Molecular Dynamics Simulations to Optimize PARP1-Specific Chemo/Radio-Potentiators for Antitumor Drug Design
H Khizer, A Maryam, A Ansari, MS Ahmad, RR Khalid
Archives of Biochemistry and Biophysics, 110010, 2024
2024
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