{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,6,22]],"date-time":"2026-06-22T08:53:54Z","timestamp":1782118434773,"version":"3.54.5"},"reference-count":56,"publisher":"American Chemical Society (ACS)","issue":"12","license":[{"start":{"date-parts":[[2026,6,1]],"date-time":"2026-06-01T00:00:00Z","timestamp":1780272000000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-029"},{"start":{"date-parts":[[2026,6,1]],"date-time":"2026-06-01T00:00:00Z","timestamp":1780272000000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-037"},{"start":{"date-parts":[[2026,6,1]],"date-time":"2026-06-01T00:00:00Z","timestamp":1780272000000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-045"}],"funder":[{"DOI":"10.13039\/501100004761","name":"Natural Science Foundation of Hainan Province","doi-asserted-by":"publisher","award":["324MS009"],"award-info":[{"award-number":["324MS009"]}],"id":[{"id":"10.13039\/501100004761","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100001809","name":"National Natural Science Foundation of China","doi-asserted-by":"publisher","award":["62262015"],"award-info":[{"award-number":["62262015"]}],"id":[{"id":"10.13039\/501100001809","id-type":"DOI","asserted-by":"publisher"}]},{"name":"Graduate Innovation Research Project of Hainan Province","award":["Qhyb2023-118"],"award-info":[{"award-number":["Qhyb2023-118"]}]}],"content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["J. Chem. Inf. Model."],"published-print":{"date-parts":[[2026,6,22]]},"DOI":"10.1021\/acs.jcim.5c03071","type":"journal-article","created":{"date-parts":[[2026,6,1]],"date-time":"2026-06-01T11:01:21Z","timestamp":1780311681000},"page":"6855-6865","source":"Crossref","is-referenced-by-count":0,"title":["MPMFMol: Multitask Self-Supervised Pretraining with Multimodal Fine-Tuning for Molecular Property Prediction"],"prefix":"10.1021","volume":"66","author":[{"given":"Yan","family":"Xia","sequence":"first","affiliation":[{"name":"School of Information and Communication Engineering","place":["Haikou, China"]},{"name":"Hainan University","place":["Haikou, China"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"An","family":"Xiong","sequence":"additional","affiliation":[{"name":"School of Computer Science and Technology","place":["Haikou, China"]},{"name":"Hainan University","place":["Haikou, China"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Yike","family":"Wang","sequence":"additional","affiliation":[{"name":"School of Computer Science and Technology","place":["Haikou, China"]},{"name":"Hainan University","place":["Haikou, China"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Junlin","family":"Xu","sequence":"additional","affiliation":[{"name":"School of Computer Science and Technology","place":["Wuhan, China"]},{"name":"Wuhan University of Science and Technology","place":["Wuhan, China"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Yajie","family":"Meng","sequence":"additional","affiliation":[{"name":"School of Computer Science and Artificial Intelligence","place":["Wuhan, China"]},{"name":"Wuhan Textile University","place":["Wuhan, China"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Leyi","family":"Wei","sequence":"additional","affiliation":[{"name":"Centre for Artificial Intelligence Driven Drug Discovery, Faculty of Applied Science","place":["Macao, China"]},{"name":"Macao Polytechnic University","place":["Macao, China"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0001-6406-1142","authenticated-orcid":true,"given":"Quan","family":"Zou","sequence":"additional","affiliation":[{"name":"Institute of Fundamental and Frontier Sciences","place":["Chengdu, China"]},{"name":"University of Electronic Science and Technology of China","place":["Chengdu, China"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0001-7055-3813","authenticated-orcid":true,"given":"Feifei","family":"Cui","sequence":"additional","affiliation":[{"name":"School of Computer Science and Technology","place":["Haikou, China"]},{"name":"Hainan University","place":["Haikou, China"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"ORCID":"https:\/\/orcid.org\/0000-0002-4934-1258","authenticated-orcid":true,"given":"Zilong","family":"Zhang","sequence":"additional","affiliation":[{"name":"School of Computer Science and Technology","place":["Haikou, China"]},{"name":"Hainan University","place":["Haikou, China"]}],"role":[{"vocabulary":"crossref","role":"author"}]},{"given":"Xiulai","family":"Li","sequence":"additional","affiliation":[{"name":"School of Computer Science and Technology","place":["Haikou, China"]},{"name":"Hainan University","place":["Haikou, China"]}],"role":[{"vocabulary":"crossref","role":"author"}]}],"member":"316","published-online":{"date-parts":[[2026,6,1]]},"reference":[{"key":"ref1\/cit1","doi-asserted-by":"publisher","DOI":"10.1038\/s41467-024-55082-4"},{"key":"ref2\/cit2","unstructured":"Feng, S.; Ni, Y.; Lu, Y. UniGEM: A Unified Approach to Generation and Property Prediction for Molecules. 2024, arXiv:2410.10516. arXiv.org e-Printarchive. https:\/\/arxiv.org\/abs\/2410.10516."},{"key":"ref3\/cit3","doi-asserted-by":"publisher","DOI":"10.1016\/j.biotechadv.2026.108843"},{"key":"ref4\/cit4","doi-asserted-by":"publisher","DOI":"10.1093\/bib\/bbad398"},{"key":"ref5\/cit5","doi-asserted-by":"publisher","DOI":"10.1016\/j.inffus.2025.103062"},{"key":"ref6\/cit6","doi-asserted-by":"publisher","DOI":"10.1093\/bib\/bbae256"},{"key":"ref7\/cit7","doi-asserted-by":"publisher","DOI":"10.1093\/bib\/bbae165"},{"key":"ref8\/cit8","doi-asserted-by":"publisher","DOI":"10.26599\/BDMA.2024.9020028"},{"key":"ref9\/cit9","doi-asserted-by":"publisher","DOI":"10.1093\/bfgp\/elae052"},{"key":"ref10\/cit10","doi-asserted-by":"publisher","DOI":"10.1186\/s12915-025-02456-9"},{"key":"ref11\/cit11","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jmedchem.4c00692"},{"key":"ref12\/cit12","doi-asserted-by":"publisher","DOI":"10.1016\/j.asoc.2024.111898"},{"key":"ref13\/cit13","unstructured":"Wang, Z.; Lin, Z.; Lin, W. Explainable Molecular Property Prediction: Aligning Chemical Concepts with Predictions via Language Models 2024, arXiv.org e-Printarchive. arXiv:2405.16041. https:\/\/arxiv.org\/abs\/2405.16041."},{"key":"ref14\/cit14","doi-asserted-by":"publisher","DOI":"10.1093\/bioinformatics\/btaf275"},{"key":"ref15\/cit15","doi-asserted-by":"publisher","DOI":"10.1038\/s42004-024-01155-w"},{"key":"ref16\/cit16","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jcim.3c00445"},{"key":"ref17\/cit17","doi-asserted-by":"publisher","DOI":"10.1038\/s41467-023-38192-3"},{"key":"ref18\/cit18","doi-asserted-by":"publisher","DOI":"10.1093\/bioinformatics\/btae304"},{"key":"ref19\/cit19","unstructured":"Vaswani, A.; Shazeer, N.; Parmar, N. In\n                      Attention is all You Need\n                      ; Proceedings of the 31st International Conference on Neural Information Processing Systems NIPS, 2017."},{"key":"ref20\/cit20","doi-asserted-by":"publisher","DOI":"10.1007\/978-3-642-24797-2_4"},{"key":"ref21\/cit21","doi-asserted-by":"publisher","DOI":"10.1109\/5.726791"},{"key":"ref22\/cit22","unstructured":"Dao, T.; Gu, A. Transformers are ssms: Generalized models and efficient algorithms through structured state space duality. 2024, arXiv:2405.21060. arXiv.org e-Printarchive https:\/\/arxiv.org\/abs\/2405.21060."},{"key":"ref23\/cit23","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jcim.5c01489"},{"key":"ref24\/cit24","unstructured":"Dai, H.; Dai, B.; Song, L. In\n                      Discriminative Embeddings of Latent Variable Models for Structured Data\n                      ; Proceedings of The 33rd International Conference on Machine Learning PMLR, 2016."},{"key":"ref25\/cit25","doi-asserted-by":"crossref","unstructured":"Song, Y.; Zheng, S.; Niu, Z. In\n                      Communicative Representation Learning on Attributed Molecular Graphs\n                      ; 29th International Joint Conference on Artificial Intelligence and the 17th Pacific Rim International Conference on Artificial Intelligence (IJCAI-PRICAI2020), 2020.","DOI":"10.24963\/ijcai.2020\/392"},{"key":"ref26\/cit26","unstructured":"Xu, K.; Hu, W.; Leskovec, J. How powerful are graph neural networks? 2018, arXiv:1810.00826. arXiv.org e-Printarchive. https:\/\/arxiv.org\/abs\/1810.00826."},{"key":"ref27\/cit27","unstructured":"Veli\u010dkovi\u0107, P.; Cucurull, G.; Casanova, A. Graph attention networks. 2017, arXiv:1710.10903. arXiv.org e-Printarchive. https:\/\/arxiv.org\/abs\/1710.10903."},{"key":"ref28\/cit28","doi-asserted-by":"publisher","DOI":"10.1007\/s11831-025-10317-5"},{"key":"ref29\/cit29","doi-asserted-by":"publisher","DOI":"10.1038\/s41467-023-43214-1"},{"key":"ref30\/cit30","doi-asserted-by":"publisher","DOI":"10.1038\/s41467-025-59634-0"},{"key":"ref31\/cit31","doi-asserted-by":"publisher","DOI":"10.1038\/s42256-024-00900-z"},{"key":"ref32\/cit32","doi-asserted-by":"publisher","DOI":"10.1186\/s13321-024-00880-7"},{"key":"ref33\/cit33","unstructured":"Rong, Y.; Bian, Y.; Xu, T. In\n                      Self-Supervised Graph Transformer on Large-Scale Molecular Data\n                      ; Proceedings of the 34th International Conference on Neural Information Processing Systems NIPS, 2020."},{"key":"ref34\/cit34","doi-asserted-by":"publisher","DOI":"10.1038\/s42256-022-00447-x"},{"key":"ref35\/cit35","doi-asserted-by":"publisher","DOI":"10.1016\/j.jmgm.2025.109014"},{"key":"ref36\/cit36","doi-asserted-by":"crossref","unstructured":"Sun, M.; Ooi, B. C.; Miao, C. In\n                      MoCL: Data-Driven Molecular Fingerprint via Knowledge-Aware Contrastive Learning from Molecular Graph\n                      ; Proceedings of the 27th ACM SIGKDD conference on knowledge discovery & data mining ACM, 2021.","DOI":"10.1145\/3447548.3467186"},{"key":"ref37\/cit37","doi-asserted-by":"publisher","DOI":"10.1038\/s42004-023-00825-5"},{"key":"ref38\/cit38","unstructured":"Wang, Z.; Jiang, T.; Wang, J. Multi-Modal Representation Learning for Molecular Property Prediction: Sequence, Graph, Geometry. 2024, arXiv:2401.03369. arXiv.org e-Printarchive. https:\/\/arxiv.org\/abs\/2401.03369."},{"key":"ref39\/cit39","doi-asserted-by":"publisher","DOI":"10.3390\/ijms25073794"},{"key":"ref40\/cit40","doi-asserted-by":"publisher","DOI":"10.1093\/bib\/bbae298"},{"key":"ref41\/cit41","doi-asserted-by":"publisher","DOI":"10.1016\/j.inffus.2025.103493"},{"key":"ref42\/cit42","doi-asserted-by":"publisher","DOI":"10.1093\/bioinformatics\/btae386"},{"key":"ref43\/cit43","doi-asserted-by":"publisher","DOI":"10.1007\/s11030-025-11350-z"},{"key":"ref44\/cit44","doi-asserted-by":"publisher","DOI":"10.1021\/acs.iecr.4c03293"},{"key":"ref45\/cit45","unstructured":"Hsu, K.; Levine, S.; Finn, C. In\n                      Unsupervised Learning via Meta-Learning\n                      ; International Conference on Learning Representations ICLR, 2019."},{"key":"ref46\/cit46","unstructured":"Juan, X.; Zhou, K.; Liu, N. In\n                      Molecular Data Programming: Towards Molecule Pseudo-labeling with Systematic Weak Supervision\n                      ; IEE\/CVF Conference on Computer Vision and Pattern Recognition (CVPR) IEEE, 2024."},{"key":"ref47\/cit47","doi-asserted-by":"publisher","DOI":"10.1038\/s42256-022-00557-6"},{"key":"ref48\/cit48","doi-asserted-by":"publisher","DOI":"10.1002\/advs.202412987"},{"key":"ref49\/cit49","doi-asserted-by":"publisher","DOI":"10.1038\/s42004-023-00857-x"},{"key":"ref50\/cit50","doi-asserted-by":"publisher","DOI":"10.1038\/s42256-023-00654-0"},{"key":"ref51\/cit51","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jcim.5b00559"},{"key":"ref52\/cit52","doi-asserted-by":"publisher","DOI":"10.1039\/C7SC02664A"},{"key":"ref53\/cit53","doi-asserted-by":"publisher","DOI":"10.1021\/acs.jcim.9b00237"},{"key":"ref54\/cit54","doi-asserted-by":"publisher","DOI":"10.1016\/j.inffus.2023.102092"},{"key":"ref55\/cit55","doi-asserted-by":"publisher","DOI":"10.1186\/s13040-024-00419-4"},{"key":"ref56\/cit56","doi-asserted-by":"publisher","DOI":"10.1609\/aaai.v36i4.20313"}],"container-title":["Journal of Chemical Information and Modeling"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/acs.jcim.5c03071","content-type":"application\/pdf","content-version":"vor","intended-application":"unspecified"},{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/acs.jcim.5c03071","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2026,6,22]],"date-time":"2026-06-22T08:41:22Z","timestamp":1782117682000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.acs.org\/doi\/10.1021\/acs.jcim.5c03071"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2026,6,1]]},"references-count":56,"journal-issue":{"issue":"12","published-print":{"date-parts":[[2026,6,22]]}},"alternative-id":["10.1021\/acs.jcim.5c03071"],"URL":"https:\/\/doi.org\/10.1021\/acs.jcim.5c03071","relation":{},"ISSN":["1549-9596","1549-960X"],"issn-type":[{"value":"1549-9596","type":"print"},{"value":"1549-960X","type":"electronic"}],"subject":[],"published":{"date-parts":[[2026,6,1]]}}}