Computational Biology and Chemistry

Papers
(The H4-Index of Computational Biology and Chemistry is 28. The table below lists those papers that are above that threshold based on CrossRef citation counts [max. 250 papers]. The publications cover those that have been published in the past four years, i.e., from 2022-06-01 to 2026-06-01.)
ArticleCitations
Multi-scale DNA language model improves 6 mA binding sites prediction93
Decision tree classifier based on topological characteristics of subgraph for the mining of protein complexes from large scale PPI networks70
Computational insights into irinotecan's interaction with UBE2I in ovarian and endometrial cancers69
Identification of angiogenesis-related subtypes and risk models for predicting the prognosis of gastric cancer patients63
Editorial Board57
Editorial Board52
Amino acid sequence-based IDR classification using ensemble machine learning and quantum neural networks51
Sesquiterpene metabolites from Pogostemon cablin leaf essential oil as acetylcholinesterase inhibitors: An integrated computational and phytochemical study50
Computational investigations of indanedione and indanone derivatives in drug discovery: Indanone derivatives inhibits cereblon, an E3 ubiquitin ligase component50
Maturity-dependent enzyme inhibition in grape seeds: Urease, α-amylase, and lipase inhibitory activities with lipase docking insights and antimicrobial properties46
Computational discovery of resiniferatoxin and euphol as potential androgen receptor inhibitors for prostate cancer therapy46
Investigation of mesenchymal stem cell secretome on breast cancer gene expression: A bioinformatic approach to identify differentially expressed genes, functional networks, and potential therapeutic t44
Computational analysis of the interactions between Ebselen and derivatives with the active site of the main protease from SARS-CoV-243
Implications of trinodal inhibitions and drug repurposing in MAPK pathway: A putative remedy for breast cancer42
Classical molecular dynamics simulation identifies catechingallate as a promising antiviral polyphenol against MPOX palmitoylated surface protein39
XP-GCN: Extreme learning machines and parallel graph convolutional networks for high-throughput prediction of blood-brain barrier penetration based on feature fusion39
Identification and validation of biomarkers in Alzheimer's disease based on machine learning algorithms and single-cell sequencing analysis37
Causal role of 46 pathogen-derived antibodies in prostate disease insights from two-sample and Bayesian-weighted Mendelian randomization36
Construction of the small intestine on molecular dynamics simulation and preliminary exploration of drug intestinal absorption prediction36
A novel parallel feature rank aggregation algorithm for gene selection applied to microarray data classification35
The interaction of methotrexate with the human C5a and its potential therapeutic implications35
Improvement of an eye disease detection model by using the denoising diffusion implicit model34
Unveiling the RAAS-modulating terpenoid, Boerhadiffusene from Boerhavia diffusa L. and further envisage its potential anti-hypertensive activity through in silico and in vitro approaches33
Trichomonas vaginalis acid sphingomyelinases' theoretical structural analysis shows substrate binding diversity related to protein flexibility and mobility31
Integrative bioinformatic discovery and in vivo validation of immune-related hub genes in renal interstitial fibrosis31
Corrigendum to “Response of the DUF630 gene family in soybean to drought stress: A comprehensive expression analysis” [Comput. Biol. Chem. 124 (Part 1) (2026) 109078]31
Integrated consensus genetic map and genomic scaffold re-ordering of oil palm (Elaeis guineensis) genome30
Thiazole inhibitors of α-glucosidase: Positional isomerism modulates selectivity, enzyme binding and potency of inhibition28
New thiazolidine-2,4-diones as effective anti-proliferative and anti-VEGFR-2 agents: Design, synthesis, in vitro, docking, MD simulations, DFT, ADMET, and toxicity studies28
Editorial Board28
RETRACTED: Revolutionizing medical imaging: A cutting-edge AI framework with vision transformers and perceiver IO for multi-disease diagnosis28
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