Works matching IS 13811991 AND DT 2022 AND VI 26 AND IP 1

Results: 40

The anti-HCV, Sofosbuvir, versus the anti-EBOV Remdesivir against SARS-CoV-2 RNA dependent RNA polymerase in silico.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 171, doi. 10.1007/s11030-020-10178-z

By:

Elfiky, Abdo A.;
Azzam, Eman B.;
Shafaa, Medhat W.

Publication type:

Article

Design, synthesis and fungicidal activity of pyrazole–thiazole carboxamide derivatives.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 205, doi. 10.1007/s11030-020-10177-0

By:

Hao, Zesheng;
Yu, Bin;
Gao, Wei;
Chen, Haoyin;
Yang, Dongyan;
Lv, You;
Zhang, Yue;
Chen, Lei;
Fan, Zhijin

Publication type:

Article

COVID-19: inflammatory responses, structure-based drug design and potential therapeutics.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 629, doi. 10.1007/s11030-020-10176-1

By:

Tripathi, Neetu;
Tripathi, Neeraj;
Goshisht, Manoj Kumar

Publication type:

Article

Curse of La Corona: unravelling the scientific and psychological conundrums of the 21st century pandemic.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 555, doi. 10.1007/s11030-020-10167-2

By:

Shukla, Arpit;
Parmar, Paritosh;
Kapoor, Gitanjali;
Goswami, Dweipayan;
Jha, Chaitanya Kumar;
Patel, Baldev;
Saraf, Meenu

Publication type:

Article

Synthesis, antifungal activity and 3D-QSAR study of novel acyl thiourea compounds containing gem-dimethylcyclopropane ring.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 125, doi. 10.1007/s11030-020-10163-6

By:

Huang, Mei;
Huang, Min;
Wang, Xiu;
Duan, Wen-Gui;
Lin, Gui-Shan;
Lei, Fu-Hou

Publication type:

Article

Novel tacrine-based acetylcholinesterase inhibitors as potential agents for the treatment of Alzheimer's disease: Quinolotacrine hybrids.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 489, doi. 10.1007/s11030-021-10307-2

By:

Sadafi Kohnehshahri, Mehrdad;
Chehardoli, Gholamabbas;
Bahiraei, Masoomeh;
Akbarzadeh, Tahmineh;
Ranjbar, Akram;
Rastegari, Arezoo;
Najafi, Zahra

Publication type:

Article

ABCpred: a webserver for the discovery of acetyl- and butyryl-cholinesterase inhibitors.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 467, doi. 10.1007/s11030-021-10292-6

By:

Malik, Aijaz Ahmad;
Ojha, Suvash Chandra;
Schaduangrat, Nalini;
Nantasenamat, Chanin

Publication type:

Article

In silico screening of neurokinin receptor antagonists as a therapeutic strategy for neuroinflammation in Alzheimer's disease.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 443, doi. 10.1007/s11030-021-10276-6

By:

Satarker, Sairaj;
Maity, Swastika;
Mudgal, Jayesh;
Nampoothiri, Madhavan

Publication type:

Article

Potential phytochemical inhibitors of SARS-CoV-2 helicase Nsp13: a molecular docking and dynamic simulation study.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 429, doi. 10.1007/s11030-021-10251-1

By:

Vivek-Ananth, R. P.;
Krishnaswamy, Sankaran;
Samal, Areejit

Publication type:

Article

Synthesis and evaluation of novel arylisoxazoles linked to tacrine moiety: in vitro and in vivo biological activities against Alzheimer's disease.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 409, doi. 10.1007/s11030-021-10248-w

By:

Rastegari, Arezoo;
Safavi, Maliheh;
Vafadarnejad, Fahimeh;
Najafi, Zahra;
Hariri, Roshanak;
Bukhari, Syed Nasir Abbas;
Iraji, Aida;
Edraki, Najmeh;
Firuzi, Omidreza;
Saeedi, Mina;
Mahdavi, Mohammad;
Akbarzadeh, Tahmineh

Publication type:

Article

Meticulous assessment of natural compounds from NPASS database for identifying analogue of GRL0617, the only known inhibitor for SARS-CoV2 papain-like protease (PLpro) using rigorous computational workflow.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 389, doi. 10.1007/s11030-021-10233-3

By:

Parmar, Paritosh;
Rao, Priyashi;
Sharma, Abhilasha;
Shukla, Arpit;
Rawal, Rakesh M.;
Saraf, Meenu;
Patel, Baldev V.;
Goswami, Dweipayan

Publication type:

Article

Identification of phytocompounds from Houttuynia cordata Thunb. as potential inhibitors for SARS-CoV-2 replication proteins through GC–MS/LC–MS characterization, molecular docking and molecular dynamics simulation.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 365, doi. 10.1007/s11030-021-10226-2

By:

Das, Sanjib Kumar;
Mahanta, Saurov;
Tanti, Bhaben;
Tag, Hui;
Hui, Pallabi Kalita

Publication type:

Article

In vitro antimicrobial evaluation and in silico studies of coumarin derivatives tagged with pyrano-pyridine and pyrano-pyrimidine moieties as DNA gyrase inhibitors.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 341, doi. 10.1007/s11030-021-10224-4

By:

Fayed, Eman A.;
Nosseir, Eman S.;
Atef, Ahmed;
El‑Kalyoubi, Samar A.

Publication type:

Article

Machine learning-based modeling to predict inhibitors of acetylcholinesterase.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 331, doi. 10.1007/s11030-021-10223-5

By:

Sandhu, Hardeep;
Kumar, Rajaram Naresh;
Garg, Prabha

Publication type:

Article

Identifying structural–functional analogue of GRL0617, the only well-established inhibitor for papain-like protease (PLpro) of SARS-CoV2 from the pool of fungal metabolites using docking and molecular dynamics simulation.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 309, doi. 10.1007/s11030-021-10220-8

By:

Rao, Priyashi;
Patel, Rohit;
Shukla, Arpit;
Parmar, Paritosh;
Rawal, Rakesh M.;
Saraf, Meenu;
Goswami, Dweipayan

Publication type:

Article

Investigation of angucycline compounds as potential drug candidates against SARS Cov-2 main protease using docking and molecular dynamic approaches.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 293, doi. 10.1007/s11030-021-10219-1

By:

Al-Bustany, Hazem Abbas;
Ercan, Selami;
Ince, Ebru;
Pirinccioglu, Necmettin

Publication type:

Article

In silico evaluation of potential inhibitory activity of remdesivir, favipiravir, ribavirin and galidesivir active forms on SARS-CoV-2 RNA polymerase.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 279, doi. 10.1007/s11030-021-10215-5

By:

Celik, Ismail;
Erol, Meryem;
Duzgun, Zekeriya

Publication type:

Article

Pharmacoinformatics-based identification of transmembrane protease serine-2 inhibitors from Morus Alba as SARS-CoV-2 cell entry inhibitors.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 265, doi. 10.1007/s11030-021-10209-3

By:

Shakya, Anshul;
Chikhale, Rupesh V.;
Bhat, Hans Raj;
Alasmary, Fatmah Ali;
Almutairi, Tahani Mazyad;
Ghosh, Surajit Kumar;
Alhajri, Hassna Mohammed;
Alissa, Siham A.;
Nagar, Shuchi;
Islam, Md Ataul

Publication type:

Article

Design, synthesis and biological evaluation of isoxazole-containing biphenyl derivatives as small-molecule inhibitors targeting the programmed cell death-1/ programmed cell death-ligand 1 immune checkpoint.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 245, doi. 10.1007/s11030-021-10208-4

By:

Zhu, Peiyu;
Zhang, Jian;
Yang, Yifei;
Wang, Lixun;
Zhou, Jinpei;
Zhang, Huibin

Publication type:

Article

Antioxidative and α-glucosidase inhibitory constituents of Polyscias guilfoylei: experimental and computational assessments.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 229, doi. 10.1007/s11030-021-10206-6

By:

Anh, Le Thi Tu;
Son, Ninh The;
Van Tuyen, Nguyen;
Thuy, Phan Thi;
Quan, Pham Minh;
Ha, Nguyen Thi Thu;
Tra, Nguyen Thanh

Publication type:

Article

Exploring naphthyl derivatives as SARS-CoV papain-like protease (PLpro) inhibitors and its implications in COVID-19 drug discovery.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 215, doi. 10.1007/s11030-021-10198-3

By:

Amin, Sk. Abdul;
Ghosh, Kalyan;
Singh, Samayaditya;
Qureshi, Insaf Ahmed;
Jha, Tarun;
Gayen, Shovanlal

Publication type:

Article

Strategies for synthesis of 1,2,4-triazole-containing scaffolds using 3-amino-1,2,4-triazole.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 717, doi. 10.1007/s11030-021-10197-4

By:

Nasri, Shima;
Bayat, Mohammad;
Kochia, Khudaidad

Publication type:

Article

Cross-coupling reactions towards the synthesis of natural products.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 647, doi. 10.1007/s11030-021-10195-6

By:

Tabassum, Shaheera;
Zahoor, Ameer Fawad;
Ahmad, Sajjad;
Noreen, Razia;
Khan, Samreen Gul;
Ahmad, Hamad

Publication type:

Article

Fukuyama reduction, Fukuyama coupling and Fukuyama–Mitsunobu alkylation: recent developments and synthetic applications.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 589, doi. 10.1007/s11030-021-10194-7

By:

Sikandar, Sana;
Zahoor, Ameer Fawad;
Naheed, Shazia;
Parveen, Bushra;
Ali, Kulsoom Ghulam;
Akhtar, Rabia

Publication type:

Article

Environmentally benign approach towards C–S cross-coupling reaction by organo-copper(II) complex.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 505, doi. 10.1007/s11030-020-10180-5

By:

Singha, Rabindranath;
Chettri, Sailesh;
Brahman, Dhiraj;
Sinha, Biswajit;
Ghosh, Pranab

Publication type:

Article

An efficient diastereoselective synthesis of novel fused 5H-furo[2,3-d]thiazolo[3,2-a]pyrimidin-5-ones via one-pot three-component reaction.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 183, doi. 10.1007/s11030-020-10173-4

By:

Tabibi, Tooba;
Esmaeili, Abbas Ali;
Mague, Joel T.

Publication type:

Article

A new synthetic approach for pyrazolo[1,5-a]pyrazine-4(5H)-one derivatives and their antiproliferative effects on lung adenocarcinoma cell line.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 113, doi. 10.1007/s11030-020-10161-8

By:

Uygun, Meltem Tan;
Amudi, Karina;
Turaçlı, İrem Doğan;
Menges, Nurettin

Publication type:

Article

Layered double hydroxides as heterogeneous catalyst systems in the cross-coupling reactions: an overview.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 569, doi. 10.1007/s11030-020-10170-7

By:

Heravi, Majid M.;
Mohammadi, Pourya

Publication type:

Article

A review on various aspects of organic synthesis using Comins' reagent.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 691, doi. 10.1007/s11030-020-10175-2

By:

Devi Priya, Duraipandi;
Lakshman, Chetan;
Roopan, Selvaraj Mohana

Publication type:

Article

Photooxidation of 2,3-dihydroquinazolin-4(1H)-ones: retention or elimination of 2-substitution.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 191, doi. 10.1007/s11030-020-10174-3

By:

Memarian, Hamid Reza;
Aghalar, Reza

Publication type:

Article

Synthesis of new chrysin derivatives with substantial antibiofilm activity.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 137, doi. 10.1007/s11030-020-10162-7

By:

Bhowmik, Sukhen;
Anand, Pragya;
Das, Riyanki;
Sen, Tirtharaj;
Akhter, Yusuf;
Das, Manash C.;
De, Utpal C.

Publication type:

Article

Designing of peptide aptamer targeting the receptor-binding domain of spike protein of SARS-CoV-2: an in silico study.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 157, doi. 10.1007/s11030-020-10171-6

By:

Devi, Arpita;
Chaitanya, Nyshadham S. N.

Publication type:

Article

Design, synthesis and SAR of antitubercular benzylpiperazine ureas.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 73, doi. 10.1007/s11030-020-10158-3

By:

Satish, Sohal;
Chitral, Rohan;
Kori, Amitkumar;
Sharma, Basantkumar;
Puttur, Jayashree;
Khan, Afreen A.;
Desle, Deepali;
Raikuvar, Kavita;
Korkegian, Aaron;
Martis, Elvis A. F.;
Iyer, Krishna R.;
Coutinho, Evans C.;
Parish, Tanya;
Nandan, Santosh

Publication type:

Article

New organosulfur metallic compounds as potent drugs: synthesis, molecular modeling, spectral, antimicrobial, drug likeness and DFT analysis.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 51, doi. 10.1007/s11030-020-10157-4

By:

Hassan, Abrar Ul;
Sumrra, Sajjad Hussain;
Zafar, Muhammad Nadeem;
Nazar, Muhammad Faizan;
Mughal, Ehsan Ullah;
Zafar, Muhammad Naveed;
Iqbal, Mazhar

Publication type:

Article

Synthesis and evaluation of ursolic acid-based 1,2,4-triazolo[1,5-a]pyrimidines derivatives as anti-inflammatory agents.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 27, doi. 10.1007/s11030-020-10154-7

By:

Zhang, Tian-Yi;
Li, Chun-Shi;
Li, Ping;
Bai, Xue-Qian;
Guo, Shu-Ying;
Jin, Ying;
Piao, Sheng-Jun

Publication type:

Article

Monophosphoramide derivatives: synthesis and crystal structure, theoretical and experimental studies of their biological effects.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 97, doi. 10.1007/s11030-020-10160-9

By:

Gholivand, Khodayar;
Roshanian, Zahra;
Rahimzadeh Dashtaki, Maryam;
Hosseini, Zahra;
Ebrahimi Valmoozi, Ali Asghar;
Sharifi, Mahboobeh;
Mohammadpanah, Fahimeh;
Rajabi, Maryam;
Ghadamyari, Mohammad;
Farshadian, Sedigheh;
Hasan Sajedi, Reza;
Khajeh, Khosro;
Akbari, Neda

Publication type:

Article

Current advances in the synthetic strategies of 2-arylbenzothiazole.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 513, doi. 10.1007/s11030-020-10149-4

By:

Sethiya, Ayushi;
Sahiba, Nusrat;
Teli, Pankaj;
Soni, Jay;
Agarwal, Shikha

Publication type:

Article

Synthesis and biological evaluation in vitro and in silico of N-propionyl-N′-benzeneacylhydrazone derivatives as cruzain inhibitors of Trypanosoma cruzi.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 39, doi. 10.1007/s11030-020-10156-5

By:

Delgado-Maldonado, Timoteo;
Nogueda-Torres, Benjamín;
Espinoza-Hicks, José C.;
Vázquez-Jiménez, Lenci K.;
Paz-González, Alma D.;
Juárez-Saldívar, Alfredo;
Rivera, Gildardo

Publication type:

Article

[TBP]<sub>2</sub>SO<sub>4</sub> ionic liquid catalyst for 4MCR of pyridazinoindazole, indazolophthalazine and pyrazolophthalazine derivatives.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 15, doi. 10.1007/s11030-020-10153-8

By:

Amirmahani, Najmeh;
Mahmoodi, Nosrat O.;
Malakootian, Mohammad;
Pardakhty, Abbas

Publication type:

Article

Itaconic acid hybrids as potential anticancer agents.

Published in:

Molecular Diversity, 2022, v. 26, n. 1, p. 1, doi. 10.1007/s11030-020-10147-6

By:

Perković, Ivana;
Beus, Maja;
Schols, Dominique;
Persoons, Leentje;
Zorc, Branka

Publication type:

Article