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For: Singh N, Chaput L, Villoutreix BO. Virtual screening web servers: designing chemical probes and drug candidates in the cyberspace. Brief Bioinform 2021;22:1790-818. [PMID: 32187356 DOI: 10.1093/bib/bbaa034] [Cited by in Crossref: 18] [Cited by in F6Publishing: 17] [Article Influence: 9.0] [Reference Citation Analysis]
Number Citing Articles
1 Singh N, Decroly E, Khatib AM, Villoutreix BO. Structure-based drug repositioning over the human TMPRSS2 protease domain: search for chemical probes able to repress SARS-CoV-2 Spike protein cleavages. Eur J Pharm Sci 2020;153:105495. [PMID: 32730844 DOI: 10.1016/j.ejps.2020.105495] [Cited by in Crossref: 18] [Cited by in F6Publishing: 18] [Article Influence: 9.0] [Reference Citation Analysis]
2 Sang Y, Mejuto JC, Xiao J, Simal-Gandara J. Assessment of Glyphosate Impact on the Agrofood Ecosystem. Plants (Basel) 2021;10:405. [PMID: 33672572 DOI: 10.3390/plants10020405] [Cited by in Crossref: 1] [Article Influence: 1.0] [Reference Citation Analysis]
3 Villoutreix BO, Calvez V, Marcelin AG, Khatib AM. In Silico Investigation of the New UK (B.1.1.7) and South African (501Y.V2) SARS-CoV-2 Variants with a Focus at the ACE2-Spike RBD Interface. Int J Mol Sci 2021;22:1695. [PMID: 33567580 DOI: 10.3390/ijms22041695] [Cited by in Crossref: 22] [Cited by in F6Publishing: 20] [Article Influence: 22.0] [Reference Citation Analysis]
4 Oh KK, Adnan M, Cho DH. Network Pharmacology Study on Morus alba L. Leaves: Pivotal Functions of Bioactives on RAS Signaling Pathway and Its Associated Target Proteins against Gout. Int J Mol Sci 2021;22:9372. [PMID: 34502281 DOI: 10.3390/ijms22179372] [Reference Citation Analysis]
5 Sánchez-Cruz N, Medina-Franco JL. Epigenetic Target Profiler: A Web Server to Predict Epigenetic Targets of Small Molecules. J Chem Inf Model 2021;61:1550-4. [PMID: 33729791 DOI: 10.1021/acs.jcim.1c00045] [Cited by in Crossref: 4] [Cited by in F6Publishing: 5] [Article Influence: 4.0] [Reference Citation Analysis]
6 Singh N, Villoutreix BO. Demystifying the Molecular Basis of Pyrazoloquinolinones Recognition at the Extracellular α1+/β3- Interface of the GABAA Receptor by Molecular Modeling. Front Pharmacol 2020;11:561834. [PMID: 33041802 DOI: 10.3389/fphar.2020.561834] [Cited by in Crossref: 1] [Cited by in F6Publishing: 1] [Article Influence: 0.5] [Reference Citation Analysis]
7 Menduti G, Rasà DM, Stanga S, Boido M. Drug Screening and Drug Repositioning as Promising Therapeutic Approaches for Spinal Muscular Atrophy Treatment. Front Pharmacol 2020;11:592234. [PMID: 33281605 DOI: 10.3389/fphar.2020.592234] [Cited by in Crossref: 4] [Cited by in F6Publishing: 4] [Article Influence: 2.0] [Reference Citation Analysis]
8 Wu Z, Ma H, Liu Z, Zheng L, Yu Z, Cao S, Fang W, Wu L, Li W, Liu G, Huang J, Tang Y. wSDTNBI: a novel network-based inference method for virtual screening. Chem Sci . [DOI: 10.1039/d1sc05613a] [Reference Citation Analysis]
9 Shen C, Weng G, Zhang X, Leung EL, Yao X, Pang J, Chai X, Li D, Wang E, Cao D, Hou T. Accuracy or novelty: what can we gain from target-specific machine-learning-based scoring functions in virtual screening? Brief Bioinform 2021:bbaa410. [PMID: 33418562 DOI: 10.1093/bib/bbaa410] [Cited by in Crossref: 2] [Cited by in F6Publishing: 2] [Article Influence: 2.0] [Reference Citation Analysis]
10 Sabe VT, Ntombela T, Jhamba LA, Maguire GEM, Govender T, Naicker T, Kruger HG. Current trends in computer aided drug design and a highlight of drugs discovered via computational techniques: A review. Eur J Med Chem 2021;224:113705. [PMID: 34303871 DOI: 10.1016/j.ejmech.2021.113705] [Reference Citation Analysis]
11 Singh N, Villoutreix BO. Resources and computational strategies to advance small molecule SARS-CoV-2 discovery: Lessons from the pandemic and preparing for future health crises. Comput Struct Biotechnol J 2021;19:2537-48. [PMID: 33936562 DOI: 10.1016/j.csbj.2021.04.059] [Cited by in Crossref: 1] [Cited by in F6Publishing: 1] [Article Influence: 1.0] [Reference Citation Analysis]
12 Oh KK, Adnan M, Cho DH. Elucidating Drug-Like Compounds and Potential Mechanisms of Corn Silk (Stigma Maydis) against Obesity: A Network Pharmacology Study. Curr Issues Mol Biol 2021;43:1906-36. [PMID: 34889899 DOI: 10.3390/cimb43030133] [Reference Citation Analysis]
13 Gushchina IV, Polenova AM, Suplatov DA, Švedas VK, Nilov DK. vsFilt: A Tool to Improve Virtual Screening by Structural Filtration of Docking Poses. J Chem Inf Model 2020;60:3692-6. [DOI: 10.1021/acs.jcim.0c00303] [Cited by in Crossref: 4] [Cited by in F6Publishing: 3] [Article Influence: 2.0] [Reference Citation Analysis]
14 Villoutreix BO, Krishnamoorthy R, Tamouza R, Leboyer M, Beaune P. Chemoinformatic Analysis of Psychotropic and Antihistaminic Drugs in the Light of Experimental Anti-SARS-CoV-2 Activities. Adv Appl Bioinform Chem 2021;14:71-85. [PMID: 33880039 DOI: 10.2147/AABC.S304649] [Cited by in Crossref: 2] [Cited by in F6Publishing: 3] [Article Influence: 2.0] [Reference Citation Analysis]
15 Medina-Franco JL, Martinez-Mayorga K, Fernández-de Gortari E, Kirchmair J, Bajorath J. Rationality over fashion and hype in drug design. F1000Res 2021;10:Chem Inf Sci-397. [PMID: 34164109 DOI: 10.12688/f1000research.52676.1] [Cited by in Crossref: 1] [Cited by in F6Publishing: 2] [Article Influence: 1.0] [Reference Citation Analysis]
16 Domenico A, Nicola G, Daniela T, Fulvio C, Nicola A, Orazio N. De Novo Drug Design of Targeted Chemical Libraries Based on Artificial Intelligence and Pair-Based Multiobjective Optimization. J Chem Inf Model 2020;60:4582-93. [PMID: 32845150 DOI: 10.1021/acs.jcim.0c00517] [Cited by in Crossref: 4] [Cited by in F6Publishing: 6] [Article Influence: 2.0] [Reference Citation Analysis]
17 Aguero S, Megy S, Eremina VV, Kalashnikov AI, Krylova SG, Kulagina DA, Lopatina KA, Fournier M, Povetyeva TN, Vorozhtsov AB, Sysolyatin SV, Zhdanov VV, Terreux R. Discovery of a Novel Non-Narcotic Analgesic Derived from the CL-20 Explosive: Synthesis, Pharmacology, and Target Identification of Thiowurtzine, a Potent Inhibitor of the Opioid Receptors and the Ion Channels. ACS Omega 2021;6:15400-11. [PMID: 34151118 DOI: 10.1021/acsomega.1c01786] [Reference Citation Analysis]
18 Galati S, Di Stefano M, Martinelli E, Poli G, Tuccinardi T. Recent Advances in In Silico Target Fishing. Molecules 2021;26:5124. [PMID: 34500568 DOI: 10.3390/molecules26175124] [Cited by in Crossref: 1] [Article Influence: 1.0] [Reference Citation Analysis]
19 Mao J, Luo QQ, Zhang HR, Zheng XH, Shen C, Qi HZ, Hu ML, Zhang H. Discovery of microtubule stabilizers with novel scaffold structures based on virtual screening, biological evaluation, and molecular dynamics simulation. Chem Biol Interact 2021;352:109784. [PMID: 34932952 DOI: 10.1016/j.cbi.2021.109784] [Reference Citation Analysis]
20 Singla RK, Joon S, Shen L, Shen B. Translational Informatics for Natural Products as Antidepressant Agents. Front Cell Dev Biol 2022;9:738838. [DOI: 10.3389/fcell.2021.738838] [Reference Citation Analysis]
21 Azevedo TSM, Silva LKB, Lima ÁS, Pereira MM, Franceschi E, Faria Soares CM. In Silico Evaluation of Enzymatic Tunnels in the Biotransformation of α-Tocopherol Esters. Front Bioeng Biotechnol 2022;9:805059. [DOI: 10.3389/fbioe.2021.805059] [Reference Citation Analysis]
22 Liu F, Pan Q, Wang L, Yi S, Liu P, Huang W. Anticancer targets and mechanisms of calycosin to treat nasopharyngeal carcinoma. BioFactors 2020;46:675-84. [DOI: 10.1002/biof.1639] [Cited by in Crossref: 4] [Cited by in F6Publishing: 5] [Article Influence: 2.0] [Reference Citation Analysis]
23 Medina-Franco JL, Sánchez-Cruz N, López-López E, Díaz-Eufracio BI. Progress on open chemoinformatic tools for expanding and exploring the chemical space. J Comput Aided Mol Des 2021. [PMID: 34143323 DOI: 10.1007/s10822-021-00399-1] [Cited by in F6Publishing: 1] [Reference Citation Analysis]