{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,5,12]],"date-time":"2026-05-12T08:09:21Z","timestamp":1778573361688,"version":"3.51.4"},"reference-count":57,"publisher":"Elsevier BV","license":[{"start":{"date-parts":[[2026,7,1]],"date-time":"2026-07-01T00:00:00Z","timestamp":1782864000000},"content-version":"tdm","delay-in-days":0,"URL":"https:\/\/www.elsevier.com\/tdm\/userlicense\/1.0\/"},{"start":{"date-parts":[[2026,7,1]],"date-time":"2026-07-01T00:00:00Z","timestamp":1782864000000},"content-version":"tdm","delay-in-days":0,"URL":"https:\/\/www.elsevier.com\/legal\/tdmrep-license"},{"start":{"date-parts":[[2026,7,1]],"date-time":"2026-07-01T00:00:00Z","timestamp":1782864000000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-017"},{"start":{"date-parts":[[2026,7,1]],"date-time":"2026-07-01T00:00:00Z","timestamp":1782864000000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-037"},{"start":{"date-parts":[[2026,7,1]],"date-time":"2026-07-01T00:00:00Z","timestamp":1782864000000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-012"},{"start":{"date-parts":[[2026,7,1]],"date-time":"2026-07-01T00:00:00Z","timestamp":1782864000000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-029"},{"start":{"date-parts":[[2026,7,1]],"date-time":"2026-07-01T00:00:00Z","timestamp":1782864000000},"content-version":"stm-asf","delay-in-days":0,"URL":"https:\/\/doi.org\/10.15223\/policy-004"}],"funder":[{"DOI":"10.13039\/501100002367","name":"Chinese Academy of Sciences","doi-asserted-by":"publisher","award":["2022327"],"award-info":[{"award-number":["2022327"]}],"id":[{"id":"10.13039\/501100002367","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100004731","name":"Natural Science Foundation of Zhejiang Province","doi-asserted-by":"publisher","award":["LZ21B020001"],"award-info":[{"award-number":["LZ21B020001"]}],"id":[{"id":"10.13039\/501100004731","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100004731","name":"Natural Science Foundation of Zhejiang Province","doi-asserted-by":"publisher","award":["SSD2024010"],"award-info":[{"award-number":["SSD2024010"]}],"id":[{"id":"10.13039\/501100004731","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100012492","name":"Youth Innovation Promotion Association","doi-asserted-by":"publisher","id":[{"id":"10.13039\/501100012492","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100004739","name":"Chinese Academy of Sciences Youth Innovation Promotion Association","doi-asserted-by":"publisher","id":[{"id":"10.13039\/501100004739","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100001809","name":"National Natural Science Foundation of China","doi-asserted-by":"publisher","award":["32471321"],"award-info":[{"award-number":["32471321"]}],"id":[{"id":"10.13039\/501100001809","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100007129","name":"Shandong Province Natural Science Foundation","doi-asserted-by":"publisher","award":["ZR2023QC257"],"award-info":[{"award-number":["ZR2023QC257"]}],"id":[{"id":"10.13039\/501100007129","id-type":"DOI","asserted-by":"publisher"}]},{"DOI":"10.13039\/501100007129","name":"Shandong Province Natural Science Foundation","doi-asserted-by":"publisher","award":["ZR2023QB240"],"award-info":[{"award-number":["ZR2023QB240"]}],"id":[{"id":"10.13039\/501100007129","id-type":"DOI","asserted-by":"publisher"}]}],"content-domain":{"domain":["elsevier.com","sciencedirect.com"],"crossmark-restriction":true},"short-container-title":["Bioresource Technology"],"published-print":{"date-parts":[[2026,7]]},"DOI":"10.1016\/j.biortech.2026.134568","type":"journal-article","created":{"date-parts":[[2026,4,6]],"date-time":"2026-04-06T01:16:13Z","timestamp":1775438173000},"page":"134568","update-policy":"https:\/\/doi.org\/10.1016\/elsevier_cm_policy","source":"Crossref","is-referenced-by-count":0,"special_numbering":"C","title":["Unlocking catalytic capacity of (S)-selective \u03c9-transaminases toward aryl methyl ketones via pocket engineering and droplet screening"],"prefix":"10.1016","volume":"452","author":[{"given":"Ping","family":"Gui","sequence":"first","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]},{"ORCID":"https:\/\/orcid.org\/0009-0001-5229-1466","authenticated-orcid":false,"given":"Xiao","family":"Li","sequence":"additional","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Wangtao","family":"Jiang","sequence":"additional","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Ruolin","family":"Yang","sequence":"additional","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Peiyao","family":"Chang","sequence":"additional","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Xingwang","family":"Qie","sequence":"additional","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Xinrui","family":"Wang","sequence":"additional","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Xuefeng","family":"Wang","sequence":"additional","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Jingjie","family":"Jiang","sequence":"additional","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Liyan","family":"Wang","sequence":"additional","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Xiaojie","family":"Guo","sequence":"additional","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Hongbin","family":"Zou","sequence":"additional","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]},{"ORCID":"https:\/\/orcid.org\/0000-0001-5614-6496","authenticated-orcid":false,"given":"Fuqiang","family":"Ma","sequence":"additional","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]}],"member":"78","reference":[{"issue":"8016","key":"10.1016\/j.biortech.2026.134568_b0005","doi-asserted-by":"crossref","first-page":"493","DOI":"10.1038\/s41586-024-07487-w","article-title":"Accurate structure prediction of biomolecular interactions with AlphaFold 3","volume":"630","author":"Abramson","year":"2024","journal-title":"Nature"},{"issue":"37","key":"10.1016\/j.biortech.2026.134568_b0010","doi-asserted-by":"crossref","DOI":"10.1073\/pnas.2405342121","article-title":"Fluorescence-activated droplet sequencing (FAD-seq) directly provides sequences of screening hits in antibody discovery","volume":"121","author":"Autour","year":"2024","journal-title":"PNAS"},{"issue":"9","key":"10.1016\/j.biortech.2026.134568_b0015","doi-asserted-by":"crossref","first-page":"3257","DOI":"10.1021\/ct300400x","article-title":"Optimization of the additive CHARMM all-atom protein force field targeting improved sampling of the backbone phi, psi and side-chain chi(1) and chi(2) dihedral angles","volume":"8","author":"Best","year":"2013","journal-title":"J. Chem. Theory Comput."},{"issue":"D1","key":"10.1016\/j.biortech.2026.134568_b0020","doi-asserted-by":"crossref","first-page":"D444","DOI":"10.1093\/nar\/gkae1082","article-title":"InterPro: the protein sequence classification resource in 2025","volume":"53","author":"Blum","year":"2025","journal-title":"Nucleic Acids Res."},{"key":"10.1016\/j.biortech.2026.134568_b0025","unstructured":"Brubaker, J.D., Kim, J.L., Wilson, K.J., Wilson, D., DiPietro, L.V. 2022. INHIBITORS OF RET."},{"issue":"6673","key":"10.1016\/j.biortech.2026.134568_b0030","doi-asserted-by":"crossref","DOI":"10.1126\/science.adh8615","article-title":"From nature to industry: Harnessing enzymes for biocatalysis","volume":"382","author":"Buller","year":"2023","journal-title":"Science"},{"issue":"1","key":"10.1016\/j.biortech.2026.134568_b0035","doi-asserted-by":"crossref","first-page":"305","DOI":"10.1111\/1751-7915.13940","article-title":"Novel transaminases from thermophiles: from discovery to application","volume":"15","author":"C\u00e1rdenas-Fern\u00e1ndez","year":"2022","journal-title":"J. Microbial. Biotechnol."},{"issue":"7","key":"10.1016\/j.biortech.2026.134568_b0040","doi-asserted-by":"crossref","first-page":"2999","DOI":"10.1007\/s00253-020-10444-y","article-title":"Fluorescence-based high-throughput screening system for R-omega-transaminase engineering and its substrate scope extension","volume":"104","author":"Cheng","year":"2020","journal-title":"Appl. Microbiol. Biotechnol."},{"issue":"10","key":"10.1016\/j.biortech.2026.134568_b0045","doi-asserted-by":"crossref","DOI":"10.1371\/journal.pcbi.1002708","article-title":"CAVER 3.0: a tool for the analysis of transport pathways in dynamic protein structures","volume":"8","author":"Chovancova","year":"2012","journal-title":"PLoS Comput. Biol."},{"issue":"W1","key":"10.1016\/j.biortech.2026.134568_b0050","doi-asserted-by":"crossref","first-page":"W478","DOI":"10.1093\/nar\/gkaf377","article-title":"ProteinsPlus: a publicly available resource for protein structure mining","volume":"53","author":"Christiane","year":"2025","journal-title":"Nucleic Acids Res."},{"issue":"39","key":"10.1016\/j.biortech.2026.134568_b0055","doi-asserted-by":"crossref","first-page":"9306","DOI":"10.1039\/C6OB01629D","article-title":"Stereoelectronic effects in the reaction of aromatic substrates catalysed by Halomonas elongata transaminase and its mutants","volume":"14","author":"Contente","year":"2016","journal-title":"Org. Biomol. Chem."},{"key":"10.1016\/j.biortech.2026.134568_b0060","article-title":"Enzyme specificity prediction using cross attention graph neural networks","volume":"1\u20133","author":"Cui","year":"2025","journal-title":"Nature"},{"issue":"4","key":"10.1016\/j.biortech.2026.134568_b0065","first-page":"359","article-title":"Transaminase catalyzed asymmetric synthesis of active pharmaceutical ingredients","volume":"6","author":"Cui","year":"2024","journal-title":"Green Synth. Catal."},{"issue":"14","key":"10.1016\/j.biortech.2026.134568_b0070","doi-asserted-by":"crossref","first-page":"7207","DOI":"10.1080\/07391102.2023.2239929","article-title":"pyGROMODS: a Python package for the generation of input files for molecular dynamic simulation with GROMACS","volume":"42","author":"Daniyan","year":"2024","journal-title":"J. Biomol. Struct. Dyn."},{"key":"10.1016\/j.biortech.2026.134568_b0075","doi-asserted-by":"crossref","DOI":"10.1016\/j.biortech.2022.128425","article-title":"An efficient and sustainable furfurylamine production from biomass-derived furfural by a robust mutant omega-transaminase biocatalyst","volume":"369","author":"Di","year":"2023","journal-title":"Bioresour. Technol."},{"key":"10.1016\/j.biortech.2026.134568_b0080","doi-asserted-by":"crossref","DOI":"10.1016\/j.biortech.2026.134103","article-title":"Site-directed mutagenesis to enhance thermostability of Caulobacter sp. D5 omega-transaminase for efficient bioamination of biobased aldehydes","volume":"446","author":"Di","year":"2026","journal-title":"Bioresour. Technol."},{"issue":"11","key":"10.1016\/j.biortech.2026.134568_b0085","doi-asserted-by":"crossref","first-page":"7749","DOI":"10.1021\/acscatal.6b02380","article-title":"Rational design of a (S)-selective-transaminase for asymmetric synthesis of (1S)-1-(1, 1'-biphenyl-2-yl) ethanamine","volume":"6","author":"Dourado","year":"2016","journal-title":"ACS Catal."},{"issue":"8","key":"10.1016\/j.biortech.2026.134568_b0090","doi-asserted-by":"crossref","first-page":"3891","DOI":"10.1021\/acs.jcim.1c00203","article-title":"AutoDock Vina 1.2.0: new docking methods, expanded force field, and python bindings","volume":"61","author":"Eberhardt","year":"2021","journal-title":"J. Chem. Inf. Model."},{"issue":"5","key":"10.1016\/j.biortech.2026.134568_b0095","doi-asserted-by":"crossref","first-page":"1592","DOI":"10.1021\/acs.jctc.2c01032","article-title":"Optimal bond constraint topology for molecular dynamics simulations of cholesterol","volume":"19","author":"Fabian","year":"2023","journal-title":"J. Chem. Theory Comput."},{"key":"10.1016\/j.biortech.2026.134568_b0100","doi-asserted-by":"crossref","DOI":"10.3389\/fchem.2021.666867","article-title":"Recent advances on sorting methods of high-throughput droplet-based microfluidics in enzyme directed evolution","volume":"9","author":"Fu","year":"2021","journal-title":"Front. Chem."},{"issue":"4","key":"10.1016\/j.biortech.2026.134568_b0105","doi-asserted-by":"crossref","first-page":"820","DOI":"10.3390\/microorganisms13040820","article-title":"Advances in the molecular modification of microbial \u03c9-transaminases for asymmetric synthesis of bulky chiral amines","volume":"13","author":"Gao","year":"2025","journal-title":"Microorganisms"},{"key":"10.1016\/j.biortech.2026.134568_b0110","doi-asserted-by":"crossref","first-page":"350","DOI":"10.1016\/j.biortech.2019.01.087","article-title":"Improvements of thermophilic enzymes: from genetic modifications to applications","volume":"279","author":"Han","year":"2019","journal-title":"Bioresource Technol."},{"key":"10.1016\/j.biortech.2026.134568_b0115","doi-asserted-by":"crossref","DOI":"10.1016\/j.biotechadv.2023.108173","article-title":"Fluorescence coupling strategies in fluorescence-activated droplet sorting (FADS) for ultrahigh-throughput screening of enzymes, metabolites, and antibodies","volume":"66","author":"Jiang","year":"2023","journal-title":"Biotechnol. Adv."},{"issue":"1","key":"10.1016\/j.biortech.2026.134568_b0120","doi-asserted-by":"crossref","first-page":"349","DOI":"10.1021\/acs.chemrev.7b00437","article-title":"Application of \u03c9-transaminases in the pharmaceutical industry","volume":"118","author":"Kelly","year":"2018","journal-title":"Chem. Rev."},{"issue":"11","key":"10.1016\/j.biortech.2026.134568_b0125","doi-asserted-by":"crossref","first-page":"2594","DOI":"10.1002\/adsc.201900184","article-title":"Combinatorial mutation analysis of \u03c9-transaminase to create an engineered variant capable of asymmetric amination of isobutyrophenone","volume":"361","author":"Kim","year":"2019","journal-title":"Adv. Synth. Catal."},{"issue":"39","key":"10.1016\/j.biortech.2026.134568_b0130","doi-asserted-by":"crossref","first-page":"9418","DOI":"10.1021\/acs.jpcb.4c04901","article-title":"Introductory tutorials for simulating protein dynamics with GROMACS","volume":"128","author":"Lemkul","year":"2024","journal-title":"J. Phys. Chem. B"},{"issue":"Pt 1","key":"10.1016\/j.biortech.2026.134568_b0135","article-title":"Multi-enzyme system for efficient bioamination of lignin-derived vanillin into vanillylamine: enzyme structural insights and pyruvate removal strategy for enhanced biocatalytic performance","volume":"320","author":"Li","year":"2025","journal-title":"Int. J. Biol. Macromol."},{"issue":"3","key":"10.1016\/j.biortech.2026.134568_b0140","doi-asserted-by":"crossref","first-page":"378","DOI":"10.1080\/10242422.2023.2241601","article-title":"Identification and characterization of a novel thermostable transaminase (TATP) from Thermorudis peleae","volume":"42","author":"Li","year":"2023","journal-title":"Biocatal. Biotransfor."},{"issue":"7","key":"10.1016\/j.biortech.2026.134568_b0145","doi-asserted-by":"crossref","first-page":"5391","DOI":"10.1021\/acscatal.4c07614","article-title":"FADS-based directed evolution of a robust Bst DNA polymerase adapting high-temperature loop-mediated isothermal amplification (HT-LAMP)","volume":"15","author":"Li","year":"2025","journal-title":"ACS Catal."},{"key":"10.1016\/j.biortech.2026.134568_b0150","doi-asserted-by":"crossref","first-page":"161","DOI":"10.3389\/fbioe.2015.00161","article-title":"Enzymes from extreme environments and their industrial applications","volume":"3","author":"Littlechild","year":"2015","journal-title":"Front. Bioeng. Biotech."},{"issue":"1","key":"10.1016\/j.biortech.2026.134568_b0155","doi-asserted-by":"crossref","first-page":"184","DOI":"10.1007\/s00253-024-13023-7","article-title":"Identification of a novel thermostable transaminase and its application in L-phosphinothricin biosynthesis","volume":"108","author":"Liu","year":"2024","journal-title":"Appl. Microbiol. Biotechnol."},{"issue":"7","key":"10.1016\/j.biortech.2026.134568_b0160","doi-asserted-by":"crossref","first-page":"1971","DOI":"10.1021\/acs.oprd.1c00376","article-title":"Engineering a transaminase for the efficient synthesis of a key intermediate for rimegepant","volume":"26","author":"Ma","year":"2022","journal-title":"Org. Process Res. Dev."},{"issue":"1","key":"10.1016\/j.biortech.2026.134568_b0165","doi-asserted-by":"crossref","first-page":"233","DOI":"10.1039\/C8CS00981C","article-title":"Advances in ultrahigh-throughput screening for directed enzyme evolution","volume":"49","author":"Markel","year":"2020","journal-title":"Chem. Soc. Rev."},{"issue":"73","key":"10.1016\/j.biortech.2026.134568_b0170","doi-asserted-by":"crossref","first-page":"69257","DOI":"10.1039\/C6RA15110H","article-title":"Identification of novel thermostable \u03c9-transaminase and its application for enzymatic synthesis of chiral amines at high temperature","volume":"6","author":"Mathew","year":"2016","journal-title":"RSC Adv."},{"issue":"17","key":"10.1016\/j.biortech.2026.134568_b0175","doi-asserted-by":"crossref","first-page":"10733","DOI":"10.1021\/acscatal.1c02053","article-title":"Computational redesign of an \u03c9-transaminase from Pseudomonas jessenii for asymmetric synthesis of enantiopure bulky amines","volume":"11","author":"Meng","year":"2021","journal-title":"ACS Catal."},{"key":"10.1016\/j.biortech.2026.134568_b0180","doi-asserted-by":"crossref","DOI":"10.3389\/fctls.2022.1049179","article-title":"Protein engineering of amine transaminases","volume":"2","author":"Meng","year":"2022","journal-title":"Front. Catal."},{"issue":"9","key":"10.1016\/j.biortech.2026.134568_b0185","doi-asserted-by":"crossref","first-page":"8","DOI":"10.1021\/acscatal.4c00987","article-title":"Practical machine learning-assisted design protocol for protein engineering: transaminase engineering for the conversion of bulky substrates","volume":"14","author":"Menke","year":"2024","journal-title":"ACS Catal."},{"issue":"9","key":"10.1016\/j.biortech.2026.134568_b0190","doi-asserted-by":"crossref","first-page":"2212","DOI":"10.1038\/nprot.2007.321","article-title":"The use of differential scanning fluorimetry to detect ligand interactions that promote protein stability","volume":"2","author":"Niesen","year":"2007","journal-title":"Nat. Protoc."},{"issue":"6","key":"10.1016\/j.biortech.2026.134568_b0195","doi-asserted-by":"crossref","first-page":"3762","DOI":"10.1021\/acscatal.0c05450","article-title":"Engineering an amine transaminase for the efficient production of a chiral sacubitril precursor","volume":"11","author":"Novick","year":"2021","journal-title":"ACS Catal."},{"issue":"11","key":"10.1016\/j.biortech.2026.134568_b0200","doi-asserted-by":"crossref","first-page":"1076","DOI":"10.1038\/nchem.2578","article-title":"Identification of (S)-selective transaminases for the asymmetric synthesis of bulky chiral amines","volume":"8","author":"Pavlidis","year":"2016","journal-title":"Nat. Chem."},{"key":"10.1016\/j.biortech.2026.134568_b0205","doi-asserted-by":"crossref","first-page":"19","DOI":"10.1038\/s44160-023-00417-0","article-title":"Engineered enzymes for the synthesis of pharmaceuticals and other high-value products","volume":"3","author":"Reetz","year":"2024","journal-title":"Nat. Synth."},{"key":"10.1016\/j.biortech.2026.134568_b0210","article-title":"Enhancing MD simulations: ASGARD\u2019s automated analysis for GROMACS","volume":"1\u201313","author":"Rodr\u00edguez-Mart\u00ednez","year":"2024","journal-title":"J. Biomol. Struct. Dyn."},{"issue":"5989","key":"10.1016\/j.biortech.2026.134568_b0215","doi-asserted-by":"crossref","first-page":"305","DOI":"10.1126\/science.1188934","article-title":"Biocatalytic asymmetric synthesis of chiral amines from ketones applied to sitagliptin manufacture","volume":"329","author":"Savile","year":"2010","journal-title":"Science"},{"issue":"17","key":"10.1016\/j.biortech.2026.134568_b0220","doi-asserted-by":"crossref","first-page":"2972","DOI":"10.1002\/adsc.202200403","article-title":"Enantioselective synthesis of pharmaceutically relevant bulky arylbutylamines using engineered transaminases","volume":"364","author":"Sheludko","year":"2022","journal-title":"Adv. Synth. Catal."},{"key":"10.1016\/j.biortech.2026.134568_b0225","doi-asserted-by":"crossref","DOI":"10.3389\/fonc.2022.1033484","article-title":"Targeted therapy of RET fusion-positive non-small cell lung cancer","volume":"12","author":"Shen","year":"2022","journal-title":"Front. Oncol."},{"key":"10.1016\/j.biortech.2026.134568_b0230","article-title":"Droplet microfluidics for single-cell analysis: from improved cell encapsulation and sorting technologies to innovative applications","volume":"87","author":"Song","year":"2025","journal-title":"Biotechnol. Adv."},{"issue":"5","key":"10.1016\/j.biortech.2026.134568_b0235","doi-asserted-by":"crossref","first-page":"566","DOI":"10.1016\/j.biotechadv.2014.12.012","article-title":"Bioinformatic analysis of a PLP-dependent enzyme superfamily suitable for biocatalytic applications","volume":"33","author":"Steffen-Munsberg","year":"2015","journal-title":"Biotechnol. Adv."},{"issue":"7","key":"10.1016\/j.biortech.2026.134568_b0240","doi-asserted-by":"crossref","first-page":"811","DOI":"10.1007\/s40265-022-01720-4","article-title":"Pralsetinib: a review in advanced RET fusion-positive NSCLC","volume":"82","author":"Syed","year":"2022","journal-title":"Drugs"},{"key":"10.1016\/j.biortech.2026.134568_b0245","doi-asserted-by":"crossref","DOI":"10.1016\/j.biortech.2022.128424","article-title":"An efficient chemoenzymatic cascade strategy for transforming biomass into furfurylamine with lobster shell-based chemocatalyst and mutated omega-transaminase biocatalyst in methyl isobutyl ketone-water","volume":"369","author":"Tang","year":"2023","journal-title":"Bioresour. Technol."},{"issue":"10","key":"10.1016\/j.biortech.2026.134568_b0250","doi-asserted-by":"crossref","first-page":"6281","DOI":"10.1021\/acs.jctc.1c00645","article-title":"gmx_MMPBSA: a new tool to perform end-state free energy calculations with GROMACS","volume":"17","author":"Vald\u00e9s-Tresanco","year":"2021","journal-title":"J. Chem. Theory Comput."},{"issue":"4","key":"10.1016\/j.biortech.2026.134568_b0255","doi-asserted-by":"crossref","first-page":"671","DOI":"10.1002\/jcc.21367","article-title":"CHARMM general force field: a force field for drug-like molecules compatible with the CHARMM all-atom additive biological force fields","volume":"31","author":"Vanommeslaeghe","year":"2010","journal-title":"J. Comput. Chem."},{"key":"10.1016\/j.biortech.2026.134568_b0260","doi-asserted-by":"crossref","DOI":"10.1016\/j.foodchem.2025.144284","article-title":"Engineering the substrate-binding pocket of Cellobiose 2-epimerase for enhancing lactulose biosynthesis","volume":"483","author":"Wu","year":"2025","journal-title":"Food Chem."},{"issue":"33","key":"10.1016\/j.biortech.2026.134568_b0265","doi-asserted-by":"crossref","first-page":"20600","DOI":"10.1021\/acs.jafc.5c05979","article-title":"Computer-aided techniques in the engineering of enzyme binding pockets: new perspectives and frontiers","volume":"73","author":"Xie","year":"2025","journal-title":"J. Agric. Food Chem."},{"issue":"52","key":"10.1016\/j.biortech.2026.134568_b0270","doi-asserted-by":"crossref","DOI":"10.1002\/ange.202212555","article-title":"Mechanism\u2010Guided computational design of \u03c9\u2010transaminase by reprograming of high-energy-barrier steps","volume":"134","author":"Yang","year":"2022","journal-title":"Angew. Chem. Int. Ed."},{"issue":"17","key":"10.1016\/j.biortech.2026.134568_b0275","doi-asserted-by":"crossref","first-page":"10406","DOI":"10.1021\/acs.jafc.4c13142","article-title":"Structural analysis and mutability landscape-guided engineering of omega-transaminase for improved catalytic performance","volume":"73","author":"Yi","year":"2025","journal-title":"J. Agric. Food Chem."},{"key":"10.1016\/j.biortech.2026.134568_b0280","doi-asserted-by":"crossref","DOI":"10.1016\/j.biortech.2024.131526","article-title":"Efficient synthesis of vanillylamine through bioamination of lignin-derived vanillin by recombinant E. coli containing omega-transaminase from Caulobacter sp. D5 in dimethyl sulfoxide-water","volume":"413","author":"Zhang","year":"2024","journal-title":"Bioresour. Technol."},{"key":"10.1016\/j.biortech.2026.134568_b0285","doi-asserted-by":"crossref","DOI":"10.1016\/j.biotechadv.2025.108597","article-title":"Rich analytic toolbox for the exploration, characterization, screening, and application studies of \u03c9-transaminases","volume":"82","author":"Zhou","year":"2025","journal-title":"Biotechnol. Adv."}],"container-title":["Bioresource Technology"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/api.elsevier.com\/content\/article\/PII:S0960852426006498?httpAccept=text\/xml","content-type":"text\/xml","content-version":"vor","intended-application":"text-mining"},{"URL":"https:\/\/api.elsevier.com\/content\/article\/PII:S0960852426006498?httpAccept=text\/plain","content-type":"text\/plain","content-version":"vor","intended-application":"text-mining"}],"deposited":{"date-parts":[[2026,5,12]],"date-time":"2026-05-12T07:20:32Z","timestamp":1778570432000},"score":1,"resource":{"primary":{"URL":"https:\/\/linkinghub.elsevier.com\/retrieve\/pii\/S0960852426006498"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2026,7]]},"references-count":57,"alternative-id":["S0960852426006498"],"URL":"https:\/\/doi.org\/10.1016\/j.biortech.2026.134568","relation":{},"ISSN":["0960-8524"],"issn-type":[{"value":"0960-8524","type":"print"}],"subject":[],"published":{"date-parts":[[2026,7]]},"assertion":[{"value":"Elsevier","name":"publisher","label":"This article is maintained by"},{"value":"Unlocking catalytic capacity of (S)-selective \u03c9-transaminases toward aryl methyl ketones via pocket engineering and droplet screening","name":"articletitle","label":"Article Title"},{"value":"Bioresource Technology","name":"journaltitle","label":"Journal Title"},{"value":"https:\/\/doi.org\/10.1016\/j.biortech.2026.134568","name":"articlelink","label":"CrossRef DOI link to publisher maintained version"},{"value":"article","name":"content_type","label":"Content Type"},{"value":"\u00a9 2026 Elsevier Ltd. All rights are reserved, including those for text and data mining, AI training, and similar technologies.","name":"copyright","label":"Copyright"}],"article-number":"134568"}}