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Vol 83, No 1 (2018) 4-[(4-Acetylphenyl)amino]-2-methylidene-4-oxobutanoic acid, a newly synthesized amide with hydrophilic and hydrophobic segments: Spectroscopic characterization and investigation of reactive properties Abstract  PDF (2,595 kB)  Supplementary Material (2,47 MB)
Sheena Y. Mary, Ebtehal S. Al-Abdullah, Haya I. Aljohar, Badiadika Narayana, Prakash S. Nayak, Baladka K. Saropjini, Stevan Armaković, Sanja J. Armaković, Christian K. Van Alsenoy, Ali A. El-Emam
 
Vol 84, No 9 (2019) Synthesis of novel 2-(piperazino-1-yl-alkyl)-1H-benzimidazole derivates and assessment of their interactions with the D2 dopamine receptor Abstract  PDF (1,610 kB)  Supplementary Material (1.93 MB)
Jelena Z. Penjišević, Deana B. Andrić, Vladimir B. Šukalović, Goran M. Roglić, Vukić Šoškić, Slađana Kostić-Rajačić
 
Vol 84, No 7 (2019) Structure–activity relationship and in silico study of unique bi-heterocycles: 5-[(2-amino-1,3-thiazol-4-yl)methyl]-1,3,4-oxadiazole-2-thiol derivatives Abstract  PDF (427 kB)  Supplementary Material (2.05 MB)
Muhammad Athar Abbasi, Muhammad Shahid Ramzan, Aziz Ur Rehman, Sabhat Zahra Siddiqui, Mubashir Hassan, Hussain Raza, Syed Adnan Ali Shah, Bushra Mirza, Sung-Yum Seo
 
Vol 83, No 5 (2018) Docking studies reveal zerumbone targets β-catenin of the Wnt–β-catenin pathway in breast cancer Abstract  PDF (3,694 kB)
Ayesha Fatima, Ahmad Bustamam H. Abdul, Rasedee Abdullah, Roghayeh Abedi Karjiban, Vannajan Sanghiran Lee
 
Vol 84, No 3 (2019) Molecular modeling studies of HIV-1 non-nucleoside reverse transcriptase inhibitors using 3D-QSAR, virtual screening and docking simulations Abstract  PDF (509 kB)
Jian-Bo Tong, Shang-Shang Qin, Shan Lei, Yang Wang
 
OnLine First - OLF Binuclear copper(II) complexes: synthesis, structural characterization, DNA binding and in silico studies Abstract  PDF (1,561 kB)
Abdul Waheed Kamran, Saqib Ali, Muhammad Nawaz Tahir, Muhammad Zahoor, Abdul Wadood, Muhammad Iqbal
 
Vol 81, No 4 (2016) Application of an R-group search technique into molecular design of HIV-1 integrase inhibitors Abstract  PDF (2,429 kB)
Jian-Bo Tong, Min Bai, Xiang Zhao
 
OnLine First - OLF Spectroscopic (FTIR, UV-Vis and NMR), theoretical investigation and molecular docking of substituted 1,8-dioxodecahydroacridine derivatives Abstract  PDF (2,625 kB)
Krishna Kant Yadav, Abhishek Kumar, Sanchari Begam, Khondekar Nurjamal, Amarendra Kumar, Goutam Brahmchari, Neeraj Misra
 
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