| no |
title |
author |
magazine |
year |
volume |
issue |
page(s) |
type |
| 1 |
A catalyst-free approach to synthesis of spiroacenaphthylene-pyranopyrazole derivatives in water media
|
Amiri, Zeinab
|
|
|
25 |
1 |
p. 121-129
|
article
|
| 2 |
A facile and efficient multicomponent ultrasound-assisted “on water” synthesis of benzodiazepine ring
|
Maury, Suresh Kumar
|
|
|
25 |
1 |
p. 131-142
|
article
|
| 3 |
Antibacterial evaluation and molecular docking studies of pyrazole–thiosemicarbazones and their pyrazole–thiazolidinone conjugates
|
Ebenezer, Oluwakemi
|
|
|
25 |
1 |
p. 191-204
|
article
|
| 4 |
Application of nitrogen-rich porous organic polymer for the solid-phase synthesis of 2-amino-4H-benzo[b]pyran scaffolds using ball milling process
|
Zaharani, Lia
|
|
|
25 |
1 |
p. 323-332
|
article
|
| 5 |
Biology-oriented drug synthesis (BIODS), in vitro urease inhibitory activity, and in silico studies on ibuprofen derivatives
|
Seraj, Faiza
|
|
|
25 |
1 |
p. 143-157
|
article
|
| 6 |
Design of potential anti-tumor PARP-1 inhibitors by QSAR and molecular modeling studies
|
Abbasi-Radmoghaddam, Zeinab
|
|
|
25 |
1 |
p. 263-277
|
article
|
| 7 |
Design, synthesis and antifungal activity of (E)-3-acyl-5-(methoxyimino)-1,5-dihydrobenzo[e][1,2]oxazepin-4(3H)-one analogues
|
Yang, Dongyan
|
|
|
25 |
1 |
p. 159-169
|
article
|
| 8 |
Design, synthesis, and molecular docking studies of new [1,2,4]triazolo[4,3-a]quinoxaline derivatives as potential A2B receptor antagonists
|
Ezzat, Hany G.
|
|
|
25 |
1 |
p. 291-306
|
article
|
| 9 |
Dihydroquinoline derivative as a potential anticancer agent: synthesis, crystal structure, and molecular modeling studies
|
Vaz, W. F.
|
|
|
25 |
1 |
p. 55-66
|
article
|
| 10 |
Discovery of new small-molecule cyclin-dependent kinase 6 inhibitors through computational approaches
|
Luo, Xiaojiao
|
|
|
25 |
1 |
p. 367-382
|
article
|
| 11 |
Diversity-oriented synthesis and antifungal activities of novel pimprinine derivative bearing a 1,3,4-oxadiazole-5-thioether moiety
|
Song, Zi-Long
|
|
|
25 |
1 |
p. 205-221
|
article
|
| 12 |
Electro-organic synthesis of tetrahydroimidazo[1,2-a]pyridin-5(1H)-one via a multicomponent reaction
|
Asghariganjeh, Mohammad Reza
|
|
|
25 |
1 |
p. 509-516
|
article
|
| 13 |
Ellagic acid and human cancers: a systems pharmacology and docking study to identify principal hub genes and main mechanisms of action
|
Cheshomi, Hamid
|
|
|
25 |
1 |
p. 333-349
|
article
|
| 14 |
Expedient synthesis of novel antibacterial hydrazono-4-thiazolidinones under catalysis of a natural-based binary ionic liquid
|
Mirakmahaleh, Maedeh Saeedi
|
|
|
25 |
1 |
p. 109-119
|
article
|
| 15 |
Fe3O4@C@OSO3H as an efficient, recyclable magnetic nanocatalyst in Pechmann condensation: green synthesis, characterization, and theoretical study
|
Samiei, Zahra
|
|
|
25 |
1 |
p. 67-86
|
article
|
| 16 |
Flexible multidentate benzyldiamine derivatives with high affinity for β-amyloid in cerebral amyloid angiopathy
|
He, Yujia
|
|
|
25 |
1 |
p. 525-533
|
article
|
| 17 |
Identification and molecular modeling of new quinolin-2-one thiosemicarbazide scaffold with antimicrobial urease inhibitory activity
|
Elbastawesy, Mohammed A. I.
|
|
|
25 |
1 |
p. 13-27
|
article
|
| 18 |
Identification of potential inhibitors of coronavirus hemagglutinin-esterase using molecular docking, molecular dynamics simulation and binding free energy calculation
|
Patel, Chirag N.
|
|
|
25 |
1 |
p. 421-433
|
article
|
| 19 |
Identification of potential Mpro inhibitors for the treatment of COVID-19 by using systematic virtual screening approach
|
Kanhed, Ashish M.
|
|
|
25 |
1 |
p. 383-401
|
article
|
| 20 |
Interaction between piperine and genes associated with sciatica and its mechanism based on molecular docking technology and network pharmacology
|
Yu, Jiu-wang
|
|
|
25 |
1 |
p. 233-248
|
article
|
| 21 |
Investigation of the cytotoxicity of bioinspired coumarin analogues towards human breast cancer cells
|
Gkionis, Leonidas
|
|
|
25 |
1 |
p. 307-321
|
article
|
| 22 |
Molecular docking studies, biological evaluation and synthesis of novel 3-mercapto-1,2,4-triazole derivatives
|
Ghanaat, Javad
|
|
|
25 |
1 |
p. 223-232
|
article
|
| 23 |
Molecular modeling of a series of dehydroquinate dehydratase type II inhibitors of Mycobacterium tuberculosis and design of new binders
|
Miranda, Paulo H. de S.
|
|
|
25 |
1 |
p. 1-12
|
article
|
| 24 |
Most recent strategies targeting estrogen receptor alpha for the treatment of breast cancer
|
Kumar, Nitish
|
|
|
25 |
1 |
p. 603-624
|
article
|
| 25 |
Novel amide derivatives of 3-phenylglutaric acid as potent soluble epoxide hydrolase inhibitors
|
Rezaee, Elham
|
|
|
25 |
1 |
p. 45-53
|
article
|
| 26 |
Novel metal complexes containing 6-methylpyridine-2-carboxylic acid as potent α-glucosidase inhibitor: synthesis, crystal structures, DFT calculations, and molecular docking
|
Avcı, Davut
|
|
|
25 |
1 |
p. 171-189
|
article
|
| 27 |
Polarizability: a promising descriptor to study chemical–biological interactions
|
Tandon, Hiteshi
|
|
|
25 |
1 |
p. 249-262
|
article
|
| 28 |
Predictive QSAR modeling for the antioxidant activity of natural compounds derivatives based on Monte Carlo method
|
Ahmadi, Shahin
|
|
|
25 |
1 |
p. 87-97
|
article
|
| 29 |
Rational approaches for the design of various GABA modulators and their clinical progression
|
Bhagat, Kavita
|
|
|
25 |
1 |
p. 551-601
|
article
|
| 30 |
Regioselective and stereoselective synthesis of epithiomethanoiminoindeno[1,2-b]furan-3-carbonitrile: heterocyclic [3.3.3]propellanes
|
Hassan, Alaa A.
|
|
|
25 |
1 |
p. 99-108
|
article
|
| 31 |
Structure-based drug design, synthesis and screening of MmaA1 inhibitors as novel anti-TB agents
|
Veeravarapu, Hymavathi
|
|
|
25 |
1 |
p. 351-366
|
article
|
| 32 |
Synthesis, biological evaluation, theoretical investigations, docking study and ADME parameters of some 1,4-bisphenylhydrazone derivatives as potent antioxidant agents and acetylcholinesterase inhibitors
|
Amine Khodja, Imene
|
|
|
25 |
1 |
p. 279-290
|
article
|
| 33 |
Synthesis, characterization, antibacterial evaluation, 2D-QSAR modeling and molecular docking studies for benzocaine derivatives
|
Taha, Israa
|
|
|
25 |
1 |
p. 435-459
|
article
|
| 34 |
Synthesis of 3,3′-methylenebis(4-hydroxyquinolin-2(1H)-ones) of prospective anti-COVID-19 drugs
|
Aly, Ashraf A.
|
|
|
25 |
1 |
p. 461-471
|
article
|
| 35 |
Synthesis of 1,2,3-triazolyl nucleoside analogues and their antiviral activity
|
Andreeva, Olga V.
|
|
|
25 |
1 |
p. 473-490
|
article
|
| 36 |
Synthetic strategies, SAR studies, and computer modeling of indole 2 and 3-carboxamides as the strong enzyme inhibitors: a review
|
Chehardoli, Gholamabbas
|
|
|
25 |
1 |
p. 535-550
|
article
|
| 37 |
Targeting the menaquinol binding loop of mycobacterial cytochrome bd oxidase
|
Harikishore, Amaravadhi
|
|
|
25 |
1 |
p. 517-524
|
article
|
| 38 |
The evaluation of 1-tetralone and 4-chromanone derivatives as inhibitors of monoamine oxidase
|
Cloete, Stephanus J.
|
|
|
25 |
1 |
p. 491-507
|
article
|
| 39 |
Therapeutics for COVID-19: from computation to practices—where we are, where we are heading to
|
Ojha, Probir Kumar
|
|
|
25 |
1 |
p. 625-659
|
article
|
| 40 |
Unexpected regio- and stereoselective [4 + 3] cycloaddition reaction of azomethine ylides with benzylidene thiazolidinediones: synthesis of pharmacologically active spiroindoline oxazepine derivatives and theoretical study
|
Zahedifar, Mahboobeh
|
|
|
25 |
1 |
p. 29-43
|
article
|
| 41 |
Unravelling the anticancer potency of 1,2,4-triazole-N-arylamide hybrids through inhibition of STAT3: synthesis and in silico mechanistic studies
|
Turky, Abdallah
|
|
|
25 |
1 |
p. 403-420
|
article
|
Journal description