Structure features of peptide-type SARS-CoV main protease inhibitors: Quantitative structure activity relationship study

por Masand, Vijay H., Akasapu, Siddhartha, Gandhi, Ajaykumar, Rastija, Vesna, Patil, Meghshyam K.
Publicado 2020

Magnetic solid phase extraction of Sunitinib malate in urine samples assisted with mixed hemimicelle and spectrophotometric detection

por Pourbasheer, Eslam, Malekpour, Leila, Azari, Zhila, Masand, Vijay H., Ganjali, Mohammad Reza
Publicado 2023

Identification of Food Compounds as inhibitors of SARS-CoV-2 main protease using molecular docking and molecular dynamics simulations

por Masand, Vijay H., Sk, Md Fulbabu, Kar, Parimal, Rastija, Vesna, Zaki, Magdi E.A.
Publicado 2021

QSAR and Pharmacophore Modeling of Nitrogen Heterocycles as Potent Human N-Myristoyltransferase (Hs-NMT) Inhibitors

por Zaki, Magdi E. A., Al-Hussain, Sami A., Masand, Vijay H., Akasapu, Siddhartha, Lewaa, Israa
Publicado 2021

Identification of potential edible mushroom as SARS-CoV-2 main protease inhibitor using rational drug designing approach

por Sen, Debanjan, Debnath, Bimal, Debnath, Pradip, Debnath, Sudhan, Zaki, Magdi E. A., Masand, Vijay H.
Publicado 2022

Mechanistic and Predictive QSAR Analysis of Diverse Molecules to Capture Salient and Hidden Pharmacophores for Anti-Thrombotic Activity

por Zaki, Magdi E. A., Al-Hussain, Sami A., Masand, Vijay H., Sabnani, Manoj K., Samad, Abdul
Publicado 2021

Quantitative Structure–Activity Relationship Evaluation of MDA-MB-231 Cell Anti-Proliferative Leads

por Gandhi, Ajaykumar, Masand, Vijay, Zaki, Magdi E. A., Al-Hussain, Sami A., Ghorbal, Anis Ben, Chapolikar, Archana
Publicado 2021

QSAR study of anti-Human African Trypanosomiasis activity for 2-phenylimidazopyridines derivatives using DFT and Lipinski's descriptors

por Chtita, Samir, Ghamali, Mounir, Ousaa, Abdellah, Aouidate, Adnane, Belhassan, Assia, Taourati, Abdelali Idrissi, Masand, Vijay Hariram, Bouachrine, Mohammed, Lakhlifi, Tahar
Publicado 2019

Mechanistic Analysis of Chemically Diverse Bromodomain-4 Inhibitors Using Balanced QSAR Analysis and Supported by X-ray Resolved Crystal Structures

por Zaki, Magdi E. A., Al-Hussain, Sami A., Al-Mutairi, Aamal A., Masand, Vijay H., Samad, Abdul, Jawarkar, Rahul D.
Publicado 2022

Perceiving the Concealed and Unreported Pharmacophoric Features of the 5-Hydroxytryptamine Receptor Using Balanced QSAR Analysis

por Bukhari, Syed Nasir Abbas, Elsherif, Mervat Abdelaziz, Junaid, Kashaf, Ejaz, Hasan, Alam, Pravej, Samad, Abdul, Jawarkar, Rahul D., Masand, Vijay H.
Publicado 2022

Synthesis and Characterization of Some New Quinoxalin-2(1H)one and 2-Methyl-3H-quinazolin-4-one Derivatives Targeting the Onset and Progression of CRC with SAR, Molecular Docking,...

por El-Sayed, Nahed N. E., Al-Otaibi, Taghreed M., Alonazi, Mona, Masand, Vijay H., Barakat, Assem, Almarhoon, Zainab M., Ben Bacha, Abir
Publicado 2021

Synthesis, Antiphospholipase A(2), Antiprotease, Antibacterial Evaluation and Molecular Docking Analysis of Certain Novel Hydrazones

por El-Sayed, Nahed N. E., Alafeefy, Ahmed M., Bakht, Mohammed A., Masand, Vijay H., Aldalbahi, Ali, Chen, Nan, Fan, Chunhai, Ben Bacha, Abir
Publicado 2016

Mesoporous Silica Modified with 2-Phenylimidazo[1,2-a] pyridine-3-carbaldehyde as an Effective Adsorbent for Cu(II) from Aqueous Solutions: A Combined Experimental and Theoretical...

por Saddik, Rafik, Hammoudan, Imad, Tighadouini, Said, Roby, Othmane, Radi, Smaail, Al-Zaben, Maha I., Ben Bacha, Abir, Masand, Vijay H., Almarhoon, Zainab M.
Publicado 2022

Synthesis, X-ray Diffraction, Thermogravimetric and DFT Analyses of Pyrimidine Derivatives

por Barakat, Assem, Al-Najjar, Hany J., Al-Majid, Abdullah M., Adil, Syed F., Ali, Mohamed, Masand, Vijay H., Ghabbour, Hazem A, Fun, Hoong-Kun
Publicado 2014

Exploring the Prominent and Concealed Inhibitory Features for Cytoplasmic Isoforms of Hsp90 Using QSAR Analysis

por Zaki, Magdi E. A., Al-Hussain, Sami A., Bukhari, Syed Nasir Abbas, Masand, Vijay H., Rathore, Mithilesh M., Thakur, Sumer D., Patil, Vaishali M.
Publicado 2022

Identification of Anti-SARS-CoV-2 Compounds from Food Using QSAR-Based Virtual Screening, Molecular Docking, and Molecular Dynamics Simulation Analysis

por Zaki, Magdi E. A., Al-Hussain, Sami A., Masand, Vijay H., Akasapu, Siddhartha, Bajaj, Sumit O., El-Sayed, Nahed N. E., Ghosh, Arabinda, Lewaa, Israa
Publicado 2021

Pharmacophore Synergism in Diverse Scaffold Clinches in Aurora Kinase B

por Masand, Vijay H., Al-Hussain, Sami A., Rathore, Mithilesh M., Thakur, Sumer D., Akasapu, Siddhartha, Samad, Abdul, Al-Mutairi, Aamal A., Zaki, Magdi E. A.
Publicado 2022

QSAR based virtual screening derived identification of a novel hit as a SARS CoV-229E 3CL(pro) Inhibitor: GA-MLR QSAR modeling supported by molecular Docking, molecular dynamics si...

por Jawarkar, R.D., Bakal, Ravindrakumar L., Zaki, Magdi E.A., Al-Hussain, Sami, Ghosh, Arabinda, Gandhi, Ajaykumar, Mukerjee, Nobendu, Samad, Abdul, Masand, Vijay H., Lewaa, Israa
Publicado 2022

Synthesis and Evaluation of Some New 4H-Pyran Derivatives as Antioxidant, Antibacterial and Anti-HCT-116 Cells of CRC, with Molecular Docking, Antiproliferative, Apoptotic and ADME...

por El-Sayed, Nahed N. E., Zaki, Magdi E. A., Al-Hussain, Sami A., Ben Bacha, Abir, Berredjem, Malika, Masand, Vijay H., Almarhoon, Zainab M., Omar, Hanaa S.
Publicado 2022

Synthesis and Biological Evaluation of Some New 3-Aryl-2-thioxo-2,3-dihydroquinazolin-4(1H)-ones and 3-Aryl-2-(benzylthio)quinazolin-4(3H)-ones as Antioxidants; COX-2, LDHA, α-Gluc...

por El-Sayed, Nahed Nasser Eid, Al-Otaibi, Taghreed M., Barakat, Assem, Almarhoon, Zainab M., Hassan, Mohd. Zaheen, Al-Zaben, Maha I., Krayem, Najeh, Masand, Vijay H., Ben Bacha, Abir
Publicado 2023