| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
Abatement of the binding of human hexokinase II enzyme monomers by in-silico method with the design of inhibitory peptides
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Karamifard, Faranak
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12 |
1 |
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artikel
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| 2 |
A molecular docking exploration of the large extracellular loop of tetraspanin CD81 with small molecules
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Bailly, Christian
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12 |
1 |
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artikel
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| 3 |
An immunoinformatic approach for developing a multi-epitope subunit vaccine against Monkeypox virus
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Nayak, Ashmad Kumar
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12 |
1 |
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artikel
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| 4 |
Anti-diabetic, anti-pancreatic lipase, and anti-protein glycation potential of Irvingia gabonensis stem bark extracts: in vitro and in silico studies
|
Omonkhua, Akhere A.
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12 |
1 |
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artikel
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| 5 |
Bioactive compounds from Morchella esculenta as potential inhibitors of RNA-binding protein La in ovarian cancer: a molecular modeling and quantum mechanics approach
|
Dairo, Gbenga
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12 |
1 |
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artikel
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| 6 |
Comparative analyses of anti-inflammatory effects of Resveratrol, Pterostilbene and Curcumin: in-silico and in-vitro evidences
|
Patil, Rashmi
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12 |
1 |
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artikel
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| 7 |
Computational identification of potential acetylcholinesterase (AChE) and monoamine oxidase-B inhibitors from Vitis vinifera: a case study of Alzheimer’s disease (AD)
|
Sofela, Salimat O.
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12 |
1 |
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artikel
|
| 8 |
Computational inhibition of S100A8 (calgranulin A) as a potential non-invasive biomarker for rheumatoid arthritis
|
Choudhury, Khushboo
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12 |
1 |
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artikel
|
| 9 |
Computational screening of damaging nsSNPs in human SOD1 genes associated with amyotrophic lateral sclerosis identifies destabilising effects of G38R and G42D mutations through in silico evaluation
|
Bhor, Samiksha
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12 |
1 |
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artikel
|
| 10 |
Cytokines inhibitory mechanism of Prunus domestica L. (Plum) peptides as potential immunomodulators against systemic lupus erythematosus: an in-silico screening
|
Gupta, Anshika
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12 |
1 |
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artikel
|
| 11 |
Design and study of bioisosteric analogues of the drug Molnupiravir as potential therapeutics against SARS-COV-2: an in silico approach
|
Ghedira, Donia
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12 |
1 |
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artikel
|
| 12 |
Discovery of potential epidermal growth factor receptor inhibitors from black pepper for the treatment of lung cancer: an in-silico approach
|
Elekofehinti, Olusola Olalekan
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12 |
1 |
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artikel
|
| 13 |
Elucidating the role of phytocompounds from Brassica oleracea var. italic (Broccoli) on hyperthyroidism: an in-silico approach
|
Daniel, Derina J. Pearlin
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12 |
1 |
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artikel
|
| 14 |
Elucidating the structural basis for the enhanced antifungal activity of amide derivative against Candida albicans: a comprehensive computational investigation
|
Kechi, Eban L.
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12 |
1 |
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artikel
|
| 15 |
Exploring gene network and protein interaction analysis of neurotrophin signaling pathway in ameloblastoma
|
Syed Zameer Ahmed, Sidhra
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12 |
1 |
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artikel
|
| 16 |
Exploring isoindolin-1-ones as potential CDK7 inhibitors using cheminformatic tools
|
Arora, Chahat
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12 |
1 |
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artikel
|
| 17 |
Exploring the anticancer potential of fluoro flavone analogues: insights from molecular docking and dynamics studies with Aurora Kinase B
|
Singh, Ipsa A.
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12 |
1 |
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artikel
|
| 18 |
Exploring the potential of 2-arylbenzimidazole scaffolds as novel α-amylase inhibitors: QSAR, molecular docking, simulation and pharmacokinetic studies
|
Aminu, Khalifa Sunusi
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12 |
1 |
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artikel
|
| 19 |
Exploring the viability of Zeatin as a prospective therapeutic candidate for investigating the complex interplay between severe acute respiratory syndrome coronavirus (SARS-CoV) and Alzheimer’s disease
|
Sriranjini, A. S.
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12 |
1 |
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artikel
|
| 20 |
Exploring the viral protease inhibitor space driven by consensus scoring-based virtual screening
|
Mushtaq, Mamona
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12 |
1 |
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artikel
|
| 21 |
GC–MS analysis, pharmacokinetic properties, molecular docking and dynamics simulation of bioactives from Curcumis maderaspatanus to target oral cancer
|
Rao, Ronisha Shankar
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12 |
1 |
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artikel
|
| 22 |
Gonorrhea caused due to antimicrobial-resistant bacteria Neisseria gonorrhoeae treated using probiotic peptide
|
Sudhakaran, Gokul
|
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12 |
1 |
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artikel
|
| 23 |
Hub gene identification and immune infiltration analysis in hepatocellular carcinoma: Computational approach
|
Pulakuntla, Swetha
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12 |
1 |
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artikel
|
| 24 |
Identification of bio-active secondary metabolites from Actinobacteria as potential drug targets against Porphyromonas gingivalis in oral squamous cell carcinoma using molecular docking and dynamics study
|
Taj, Zarin
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12 |
1 |
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artikel
|
| 25 |
Identification of molecular interactions of pesticides with keratinase for their potential to inhibit keratin biodegradation
|
Gahatraj, Indira
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12 |
1 |
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artikel
|
| 26 |
Identification of phytoconstituents from Dicliptera paniculata and study of antibacterial activity guided by molecular docking
|
Sarkar, Alekhya
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12 |
1 |
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artikel
|
| 27 |
Identification of potential marine bioactive compounds from brown seaweeds towards BACE1 inhibitors: molecular docking and molecular dynamics simulations approach
|
Dhanabalan, Anantha Krishnan
|
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12 |
1 |
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artikel
|
| 28 |
Identification of the potential phytocompounds from Endostemon viscosus against GAPDH : a computational approach
|
Surendran, Kavi Malar
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12 |
1 |
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artikel
|
| 29 |
Identifying citrus limonoids as a potential fusion inhibitor of DENV-2 virus through its in silico study and FTIR analysis
|
Das, Satyajit
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12 |
1 |
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artikel
|
| 30 |
Inhibition of Uridine 5′-diphospho-glucuronosyltransferases A10 and B7 by vitamins: insights from in silico and in vitro studies
|
Pande, Sonal
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12 |
1 |
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artikel
|
| 31 |
Insights on the dynamic behavior of protein disulfide isomerase in the solution environment through the SAXS technique
|
Sanyasi, Chandrasekar
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12 |
1 |
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artikel
|
| 32 |
In silico analysis of virulence factors of Streptococcus uberis for a chimeric vaccine design
|
Yılmaz Çolak, Çiğdem
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|
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12 |
1 |
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artikel
|
| 33 |
In silico bioprospecting of receptors associated with the mechanism of action of Rondonin, an antifungal peptide from spider Acanthoscurria rondoniae haemolymph
|
Muniz Seif, Elias Jorge
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12 |
1 |
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artikel
|
| 34 |
In silico exploration of hypothetical proteins in Neisseria gonorrhoeae for identification of therapeutic targets
|
Lakhanpal, Gunjan
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12 |
1 |
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artikel
|
| 35 |
In silico identification and in vitro validation of alpha-hederin as a potent inhibitor of Wnt/β-catenin signaling pathway in breast cancer stem cells
|
Saliu, Tolulope Peter
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12 |
1 |
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artikel
|
| 36 |
In silico investigation of cannabinoids from Cannabis sativa leaves as a potential anticancer drug to inhibit MAPK-ERK signaling pathway and EMT induction
|
Iqbal, Shabnoor
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12 |
1 |
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artikel
|
| 37 |
In silico pharmacokinetic and therapeutic evaluation of Musa acuminata peels against aluminium chloride-induced hepatotoxicity in adult BALB/c mice
|
Onohuean, Hope
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12 |
1 |
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artikel
|
| 38 |
In silico prospection of receptors associated with the biological activity of U1-SCTRX-lg1a: an antimicrobial peptide isolated from the venom of Loxosceles gaucho
|
de Oliveira, André Souza
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12 |
1 |
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artikel
|
| 39 |
In-silico screening of phytomolecules against multiple targets for wound management
|
Thomas, Asha
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12 |
1 |
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artikel
|
| 40 |
Investigation of alpha amylase inhibitors from Bidens pilosa L. by in silico and in vitro studies
|
Galagali, Akshay
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12 |
1 |
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artikel
|
| 41 |
In vitro combination effects of plant-derived quercetin with synthetic bicalutamide on prostate cancer and normal cell lines: in silico comparison
|
Inala, Mary Shobha Rani
|
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12 |
1 |
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artikel
|
| 42 |
Molecular docking of antidiabetic molecules of libas (Spondias pinnata) fruit and prediction of their pharmacokinetic properties
|
Diacos, Joy Elaine K.
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12 |
1 |
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artikel
|
| 43 |
Molecular docking of curcumin and curcuminoids as human Zn+ dependent histone deacetylase (HDAC) enzyme inhibitors
|
Anandaradje, Annuja
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12 |
1 |
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artikel
|
| 44 |
Molecular interaction and MD-simulations: investigation of Sizofiran as a promising anti-cancer agent targeting eIF4E in colorectal cancer
|
Samykannu, Gopinath
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12 |
1 |
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artikel
|
| 45 |
Network pharmacology prediction and molecular docking-based strategy to explore the potential mechanism of squalene against inflammation
|
Luke, Shana Sara
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|
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12 |
1 |
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artikel
|
| 46 |
Phytochemical analysis, physicochemical, pharmacokinetic properties and molecular docking studies of bioactive compounds in Ottelia alismoides (L.) pers. Against breast cancer proteins
|
Muthukrishnan, Sathish
|
|
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12 |
1 |
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artikel
|
| 47 |
Phytochemical identification and in silico elucidation of interactions of bioactive compounds from Citrullus lanatus with androgen receptor towards prostate cancer treatment
|
Demian, Miracle Destiny
|
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12 |
1 |
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artikel
|
| 48 |
Potentiality of bioactive compounds as inhibitor of M protein and F protein function of human respiratory syncytial virus
|
Mitra, Debanjan
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12 |
1 |
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artikel
|
| 49 |
Predicting phase-I metabolism of piceatannol: an in silico study
|
Rajan, Ravi Kumar
|
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12 |
1 |
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artikel
|
| 50 |
Predicting Plasmodium falciparum kinase inhibitors from antimalarial medicinal herbs using computational modeling approach
|
Adelusi, Temitope Isaac
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12 |
1 |
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artikel
|
| 51 |
Steroidal lactones from Withania somnifera effectively target Beta, Gamma, Delta and Omicron variants of SARS-CoV-2 and reveal a decreased susceptibility to viral infection and perpetuation: a polypharmacology approach
|
Srivastava, Aditi
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12 |
1 |
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artikel
|
| 52 |
Strategic pathway analysis for dual management of epilepsy and comorbid depression: a systems biology perspective
|
Kaur, Arvinder
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12 |
1 |
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artikel
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| 53 |
Systems biology approach: identification of hub genes, signaling pathways, and molecular docking of COL1A1 gene in cervical insufficiency
|
Shah, Sushma
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12 |
1 |
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artikel
|
| 54 |
Targeting of wnt signalling pathway by small bioactive molecules for the treatment of Alzheimer’s disease
|
Dutta, Ankumoni
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12 |
1 |
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artikel
|
| 55 |
The artificial neural network selects saccharides from natural sources a promise for potential FimH inhibitor to prevent UTI infections
|
Dhanalakshmi, Menamadathil
|
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12 |
1 |
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artikel
|
| 56 |
Unraveling the therapeutic potential of Senna singueana phytochemicals to attenuate pancreatic cancer using protein–protein interactions, molecular docking, and MD simulation
|
Balkrishna, Acharya
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12 |
1 |
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artikel
|
| 57 |
Virtual screening of acetylcholinesterase inhibitors through pharmacophore-based 3D-QSAR modeling, ADMET, molecular docking, and MD simulation studies
|
Kumar, Hitesh
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12 |
1 |
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artikel
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