Ali A El-Emam

Publication Activity (10 Years)

Years Active: 2021-2024
Publications (10 Years): 14

Top Topics

Molecular Docking

Computed Tomography

Capillary Electrophoresis

Crystal Structure

Top Venues

Molecules (Basel, Switzerland)

This page only lists publications with an associated author ORCID identifier.

Publications

Lamya H Al-Wahaibi, Ali A El-Emam, Mohammed S M Abdelbaky, Santiago Garcia-Granda, Anushree Maurya, Mamta Pal, Zohra Siddiqui, Raj Shukla, Shilendra K Pathak, Ruchi Srivastava, Vikas K Shukla, Onkar Prasad, Leena Sinha
Structural Characterization, Spectroscopic Profile, Molecular Docking, ADMET Properties, Molecular Dynamics Simulation Studies, and Molecular Mechanics Generalized Born Surface Area Analysis of 5-(Adamantan-1-yl)-4-butyl-2,4-dihydro-3 H -1,2,4-triazole-3-thione as a Potential COX Inhibitor. ACS omega 9 (24) (2024)
Lamya H Al-Wahaibi, Ali A El-Emam, Mohammed S M Abdelbaky, Santiago Garcia-Granda, Anushree Maurya, Mamta Pal, Zohra Siddiqui, Raj Shukla, Shilendra K Pathak, Ruchi Srivastava, Vikas K Shukla, Onkar Prasad, Leena Sinha
Structural Characterization, Spectroscopic Profile, Molecular Docking, ADMET Properties, Molecular Dynamics Simulation Studies, and Molecular Mechanics Generalized Born Surface Area Analysis of 5-(Adamantan-1-yl)-4-butyl-2,4-dihydro-3 H -1,2,4-triazole-3-thione as a Potential COX Inhibitor. ACS omega 9 (24) (2024)
Lamya H Al-Wahaibi, Kowsalya Alagappan, Rosa Maria Gomila, Olivier Blacque, Antonio Frontera, María Judith Percino, Ali A El-Emam, Subbiah Thamotharan
A combined crystallographic and theoretical investigation of noncovalent interactions in 1,3,4-oxadiazole-2-thione- N -Mannich derivatives: in vitro bioactivity and molecular docking. RSC advances 13 (48) (2023)
Fatmah A M Al-Omary, Natalia Alvarez, Lamees S Al-Rasheed, Nicolás Veiga, Hanan M Hassan, Ali A El-Emam
Novel Adamantane-Linked Isothiourea Derivatives as Potential Chemotherapeutic Agents: Synthesis, Structural Insights, and Antimicrobial/Anti-Proliferative Profiles. ACS omega 8 (14) (2023)
Lamya H Al-Wahaibi, Kowsalya Alagappan, Olivier Blacque, Ahmed A B Mohamed, Hanan M Hassan, María Judith Percino, Ali A El-Emam, Subbiah Thamotharan
X-ray Structures and Computational Studies of Two Bioactive 2-(Adamantane-1-carbonyl)- N -substituted Hydrazine-1-carbothioamides. Molecules (Basel, Switzerland) 27 (23) (2022)
Lamya H Al-Wahaibi, Kowsalya Alagappan, Olivier Blacque, Ahmed A B Mohamed, Hanan M Hassan, María Judith Percino, Ali A El-Emam, Subbiah Thamotharan
X-ray Structures and Computational Studies of Two Bioactive 2-(Adamantane-1-carbonyl)- N -substituted Hydrazine-1-carbothioamides. Molecules (Basel, Switzerland) 27 (23) (2022)
Lamya H Al-Wahaibi, Kowsalya Alagappan, Olivier Blacque, Ahmed A B Mohamed, Hanan M Hassan, María Judith Percino, Ali A El-Emam, Subbiah Thamotharan
X-ray Structures and Computational Studies of Two Bioactive 2-(Adamantane-1-carbonyl)- N -substituted Hydrazine-1-carbothioamides. Molecules (Basel, Switzerland) 27 (23) (2022)
Lamya H Al-Wahaibi, Kowsalya Alagappan, Olivier Blacque, Ahmed A B Mohamed, Hanan M Hassan, María Judith Percino, Ali A El-Emam, Subbiah Thamotharan
X-ray Structures and Computational Studies of Two Bioactive 2-(Adamantane-1-carbonyl)- N -substituted Hydrazine-1-carbothioamides. Molecules (Basel, Switzerland) 27 (23) (2022)
Lamya H Al-Wahaibi, Karthick Vishal Asokan, Nora H Al-Shaalan, Samar S Tawfik, Hanan M Hassan, Ali A El-Emam, María Judith Percino, Subbiah Thamotharan
Supramolecular Self-Assembly Mediated by Multiple Hydrogen Bonds and the Importance of C-S···N Chalcogen Bonds in N '-(Adamantan-2-ylidene)hydrazide Derivatives. ACS omega 7 (12) (2022)
Lamya H Al-Wahaibi, Mario A Macías, Olivier Blacque, Luke S Zondagh, Jacques Joubert, Subbiah Thamotharan, María Judith Percino, Ahmed A B Mohamed, Ali A El-Emam
Weak Noncovalent Interactions in Three Closely Related Adamantane-Linked 1,2,4-Triazole N -Mannich Bases: Insights from Energy Frameworks, Hirshfeld Surface Analysis, In Silico 11β-HSD1 Molecular Docking and ADMET Prediction. Molecules (Basel, Switzerland) 27 (21) (2022)
Lamya H Al-Wahaibi, Sekar Karthikeyan, Olivier Blacque, Amal A El-Masry, Hanan M Hassan, María Judith Percino, Ali A El-Emam, Subbiah Thamotharan
Structural and Energetic Properties of Weak Noncovalent Interactions in Two Closely Related 3,6-Disubstituted-[1,2,4]triazolo[3,4- b ][1,3,4]thiadiazole Derivatives: In Vitro Cyclooxygenase Activity, Crystallography, and Computational Investigations. ACS omega 7 (38) (2022)
Aya Y Hemaida, Ghada S Hassan, Azza R Maarouf, Jacques Joubert, Ali A El-Emam
Synthesis and Biological Evaluation of Thiazole-Based Derivatives as Potential Acetylcholinesterase Inhibitors. ACS omega 6 (29) (2021)
Doaa A Osman, Mario A Macías, Lamya H Al-Wahaibi, Nora H Al-Shaalan, Luke S Zondagh, Jacques Joubert, Santiago Garcia-Granda, Ali A El-Emam
Structural Insights and Docking Analysis of Adamantane-Linked 1,2,4-Triazole Derivatives as Potential 11β-HSD1 Inhibitors. Molecules (Basel, Switzerland) 26 (17) (2021)
Aamal A Al-Mutairi, Kowsalya Alagappan, Olivier Blacque, Monirah A Al-Alshaikh, Ali A El-Emam, María Judith Percino, Subbiah Thamotharan
Crystallographic and Theoretical Exploration of Weak Hydrogen Bonds in Arylmethyl N'-(adamantan-1-yl)piperidine-1-carbothioimidates and Molecular Docking Analysis. ACS omega 6 (41) (2021)