{"doi":"10.1039/d4me00197d","title":"Toward understanding biomolecular materials comprising intrinsically disordered proteins <i>via</i> simulation and experiment","abstract":"Intrinsically disordered proteins (IDPs) yield solutions with tunable phase transition behavior and have been widely applied in designing stimuli-responsive materials. Understanding interactions between amino acid residues of the IDP sequence is critical to designing new IDP-based materials with selective phase behavior, assembly, and mechanical properties. The lack of defined structure for this class of proteins complicates accurate prediction of their molecular-scale behavior. In this review, recent progress is presented in the development and application of simulation methods to describe the behavior of IDPs. Results for elastin-like polypeptides (ELPs) and resilin-like polypeptides (RLPs) are highlighted, focusing on studies that compare simulation results with experimental findings.","journal":"Molecular Systems Design & Engineering","year":2025,"id":543931,"datarank":0.0,"base_score":0.0,"endowment":0.0,"self_citation_contribution":0.0,"citation_network_contribution":0.0,"self_endowment_contribution":0.0,"citer_contribution":0.0,"corpus_percentile":null,"corpus_rank":null,"citation_count":1,"citer_count":0,"citers_with_citation_signal":0,"citers_with_endowment":0,"datacite_reuse_total":0,"is_dataset":false,"is_dataset_confidence":0.9624,"is_data_producer":false,"deposit_databanks":null,"is_oa":true,"file_count":0,"downloads":0,"has_version_chain":false,"published_date":"2025-01-01","fair_score":null,"fair_percentile":null,"algorithm_id":"datarank_citation_only_1hop_v6","ranking_scope":"data_only","authors":[{"id":1243494,"name":"Tianren Zhang","orcid":"0000-0003-2899-5727","position":1,"is_corresponding":false},{"id":1433853,"name":"Sirui Shen","orcid":"0009-0003-7886-8221","position":2,"is_corresponding":false},{"id":843717,"name":"Darrin J. Pochan","orcid":"0000-0002-0454-2339","position":3,"is_corresponding":false},{"id":522055,"name":"Jeffery G. Saven","orcid":"0000-0001-5027-7241","position":4,"is_corresponding":false},{"id":307397,"name":"Kristi L. Kiick","orcid":"0000-0001-8587-0301","position":5,"is_corresponding":false},{"id":1425815,"name":"Bin Wang","orcid":"0000-0002-7835-7160","position":0,"is_corresponding":true}],"reference_count":143,"raw_metadata":null,"created_at":"2026-07-19T02:53:08.338070Z","pmid":"40386766","pmcid":null,"fwci":null,"citation_percentile":null,"influential_citations":0,"oa_status":null,"license":null,"views":0,"total_file_size_bytes":0,"version_count":0,"fair_f":null,"fair_a":null,"fair_i":null,"fair_r":null,"fair_zscore":null,"fair_rationale":null,"fair_model":null,"fair_agent_version":null,"fair_fulltext_source":null,"fair_has_llm":null,"fair_computed_at":null,"clinical_trials":[],"software_tools":[],"db_accessions":[],"linked_datasets":[],"topics":[]}