Latest Research in Biochemical Predictive Modeling

Top Research Topics in Biochemical Predictive Modeling

• Machine Learning — 46 papers
• Advanced NMR Techniques and Applications — 20 papers
• Machine Learning in Materials Science — 16 papers
• Computational Drug Discovery Methods — 13 papers
• Bacterial Genetics and Biotechnology — 11 papers
• Glycosylation and Glycoproteins Research — 10 papers
• Trypanosoma species research and implications — 10 papers
• Chemical Physics — 9 papers
• RNA Research and Splicing — 9 papers
• Mass Spectrometry Techniques and Applications — 8 papers

Highest-Cited Papers

1. Dual plasmepsin IX and X inhibitors are refractory to development of resistance (2 citations)
2. Rouhani et al. ‘Formaldehyde Emissions From 2‐Octyl Cyanoacrylate: Quantified Risk for Allergic Contact Dermatitis’ (1 citations)
3. Promiscuous Metal Site in Hepatitis B Virus X Protein Binds an Fe–S Cluster (1 citations)
4. In situ learning-based spin engineering of pulsed dynamic nuclear polarization (1 citations)
5. In-Context Molecular Property Prediction with LLMs: A Blinding Study on Memorization and Knowledge Conflicts (1 citations)
6. Design, Synthesis, and Antimicrobial Activity of Novel Cyt- bd Inhibitors Targeting Energy Compensation in Mycobacterium tuberculosis
7. Discovery of Novel Peptides as DPP-IV Inhibitors: In Silico Screening, Molecular Dynamics Simulations, and Preliminary In Vitro Evaluation
8. Ultrahigh resolution 19F and 31P NMR spectroscopy
9. Toward Rational Design of Orally Bioavailable PROTACs: Development of a Fully Computational Oral Absorption Score
10. Functional analysis of the methanobactin-encoding gene cluster of Methylocystis sp. strain SB2
11. Carbohydrate‐Directed Labeling Probes for UV‐Independent Chemoproteomic Profiling of Carbohydrate–Protein Interactions
12. The status of RpoS impacts the 2-aminoacrylate stress paradigm in ridA mutants of Salmonella enterica serovar Typhimurium
13. Public Database Leakage Distorts Model Rankings in Real-Spectra NMR Structure Elucidation
14. Antileishmanial activity of gold(I) compounds containing triphenylphosphine ligands against Leishmania amazonensis: impacts on mitochondrial bioenergetics and trypanothione reductase activity
15. Selenium Supplementation Attenuates NET DNA-Mediated Intestinal Epithelial Pyroptosis and Intestinal Barrier Injury in MRSA Enteritis via Upregulating Selenoprotein S
16. Design rules for bioorthogonal glycan-based tools
17. Carbohydrate‐Directed Labeling Probes for UV‐Independent Chemoproteomic Profiling of Carbohydrate–Protein Interactions
18. Dry Selection and Wet Evaluation of New 1,2-Disubstituted Nitroindazolin-3-One Derivatives as Promising Agents Against Trypanosoma cruzi
19. Domain Dissolution in Supported Lipid Bilayers Triggered by Unsaturated Phospholipid Addition
20. Diff-SelfA-PepGSI: A Diffusion-Based Framework for De Novo Generation, Screening, and Morphological Identification of Self-Assembled Peptide Sequences

Sub-Regions

• Microbial Genetic Systems — 116 papers
• Magnetic Resonance Spectroscopy — 89 papers
• Microbial Biofilm Signaling — 67 papers
• Glycan Functional Biochemistry — 58 papers
• Generative Molecular Design — 56 papers
• Reaction Retrosynthesis Automation — 36 papers
• Structure-Based Drug Engineering — 23 papers
• Protein Sequence Codesign — 14 papers