| AI | Artificial Intelligence |
| BindingDB | Binding Database |
| BioGRID | Biological General Repository for Interaction Datasets |
| BioLiP | Biologically Relevant Ligand–Protein Binding Interactions Database |
| BSA | Bovine Serum Albumin |
| CAFA | Critical Assessment of Protein Function Annotation |
| ChEMBL | Chemogenomic Database |
| CNN | Convolutional Neural Network |
| CNTs | Carbon Nanotubes |
| CSI | Cell Shape Index |
| DFT | Density Functional Theory |
| DIP | Database of Interacting Proteins |
| DL | Deep Learning |
| DNA | Deoxyribonucleic Acid |
| DNNs | Deep Neural Networks |
| DrugBank | Drug and Drug Target Database |
| DWCNTs | Doublewalled Carbon Nanotubes |
| ENMs | Engineered Nanomaterials |
| ERA | Environmental Risk Assessment |
| ERT | Extremely Randomized Tree |
| FAIR | Findable, Accessible, Interoperable, and Reusable |
| GBDT | Gradient-Boosting Decision Tree |
| GLASS | GPCR–Ligand Association |
| GO | Gene Ontology |
| GPCR | G-Protein-Coupled Receptor |
| GPCRdb | G-Protein-Coupled Receptor Database |
| His | Histidine |
| HPRD | Human Protein Reference Database |
| IntAct | Molecular Interaction Database |
| KGsim2vec | Knowledge-Graph-Based Method |
| KNN | K-Nearest Neighbor |
| LigAsite | Ligand Attachment Site Database |
| LightGBM | Light Gradient-Boosting Machine |
| LLMPs | Large Language Models for Proteins |
| MD | Molecular Dynamics |
| ML | Machine Learning |
| MWCNTs | Multiwalled Carbon Nanotubes |
| NAFs | Nuclear Area Factors |
| NBRP | NP Blood Removal Pathways |
| NMs | Nanomaterials |
| NN | Neural Networks |
| NPs | Nanoparticles |
| RPA | Relative Protein Abundance |
| PCRO-RLRM | Polypeptide Chemical Reaction Optimized Resistant Logistic Regression Model |
| PDB | Protein Data Bank |
| PDBbind | Binding Affinity Data for Biomolecular Complexes Deposited in the PDB |
| PepPIs/PPIs | Peptide/Protein–Protein Interactions |
| Phe | Phenylalanine |
| Phos | Phosphorylation |
| PLIs | Protein–Ligand Interactions |
| PSSM | Position-Specific Scoring Matrix |
| PPIs | Protein–Protein Interactions |
| QSAR | Quantitative Structure–Activity Relationship |
| PubChem | Public Chemical Information Resource |
| R2 | Coefficient of Determination |
| RF | Random Forest |
| RNA | Ribonucleic Acid |
| SHAP | SHapley Additive exPlanations |
| SKEMPI | Structural Kinetic and Energetic Database of Mutant Protein Interactions |
| SOM | Self-Organizing Map |
| STRING | Search Tool for the Retrieval of Interacting Genes/Proteins |
| SVM | Support Vector Machine |
| Trp | Tryptophan |
| Tyr | Tyrosine |
| UMOD | Uromodulin |
| UniProt | Universal Protein Resource |
| XGBoost | Extreme Gradient Boosting |