日期:
2020 年 — 2026 年
2020
2021
2022
2023
2024
2025
2026
影响因子:

Atom-level enzyme active site scaffolding using RFdiffusion2

利用 RFdiffusion2 进行原子级酶活性位点支架构建

Ahern, Woody; Yim, Jason; Tischer, Doug; Salike, Saman; Woodbury, Seth M; Kim, Donghyo; Kalvet, Indrek; Kipnis, Yakov; Coventry, Brian; Altae-Tran, Han Raut; Bauer, Magnus S; Barzilay, Regina; Jaakkola, Tommi S; Krishna, Rohith; Baker, David

Computational design of serine hydrolases

丝氨酸水解酶的计算设计

Lauko, Anna; Pellock, Samuel J; Sumida, Kiera H; Anishchenko, Ivan; Juergens, David; Ahern, Woody; Jeung, Jihun; Shida, Alexander F; Hunt, Andrew; Kalvet, Indrek; Norn, Christoffer; Humphreys, Ian R; Jamieson, Cooper; Krishna, Rohith; Kipnis, Yakov; Kang, Alex; Brackenbrough, Evans; Bera, Asim K; Sankaran, Banumathi; Houk, K N; Baker, David

De novo design and evolution of an artificial metathase for cytoplasmic olefin metathesis

从头设计并进化一种用于胞质烯烃复分解反应的人工复分解酶

Zou, Zhi; Kalvet, Indrek; Lozhkin, Boris; Morris, Elinor; Zhang, Kailin; Chen, Dongping; Ernst, Marco L; Zhang, Xiang; Baker, David; Ward, Thomas R

Modeling protein-small molecule conformational ensembles with PLACER

利用PLACER对蛋白质-小分子构象集合进行建模

Anishchenko, Ivan; Kipnis, Yakov; Kalvet, Indrek; Zhou, Guangfeng; Krishna, Rohith; Pellock, Samuel J; Lauko, Anna; Lee, Gyu Rie; An, Linna; Dauparas, Justas; DiMaio, Frank; Baker, David

De novo design of phospho-tyrosine peptide binders

从头设计磷酸酪氨酸肽结合剂

Bauer, Magnus S; Zhang, Jason Z; Wu, Kejia; Lee, Gyu Rie; Coventry, Brian; Klupt, Kody A; Shi, Jiuhan; Brent, Rafael I; Li, Xinting; Moller, Carolina; Roullier, Nicole; Vafeados, Dionne K; Kalvet, Indrek; Skotheim, Rebecca K; Zhu, Siyu; Motmaen, Amir; Herrmann, Luca C; Sturmfels, Pascal; Tischer, Doug; Altae-Tran, Han Raut; Juergens, David; Krishna, Rohith; Ahern, Woody; Yim, Jason; Bera, Asim K; Kang, Alex; Joyce, Emily; Lu, Andrew; Stewart, Lance; DiMaio, Frank; Baker, David

Improving Protein Expression, Stability, and Function with ProteinMPNN

利用 ProteinMPNN 改善蛋白质表达、稳定性和功能

Sumida, Kiera H; Núñez-Franco, Reyes; Kalvet, Indrek; Pellock, Samuel J; Wicky, Basile I M; Milles, Lukas F; Dauparas, Justas; Wang, Jue; Kipnis, Yakov; Jameson, Noel; Kang, Alex; De La Cruz, Joshmyn; Sankaran, Banumathi; Bera, Asim K; Jiménez-Osés, Gonzalo; Baker, David

Design of Heme Enzymes with a Tunable Substrate Binding Pocket Adjacent to an Open Metal Coordination Site

设计具有可调控底物结合口袋且毗邻开放金属配位位点的血红素酶

Kalvet, Indrek; Ortmayer, Mary; Zhao, Jingming; Crawshaw, Rebecca; Ennist, Nathan M; Levy, Colin; Roy, Anindya; Green, Anthony P; Baker, David

Selective ortho-Functionalization of Adamantylarenes Enabled by Dispersion and an Air-Stable Palladium(I) Dimer

分散和空气稳定的钯(I)二聚体实现了金刚烷基芳烃的选择性邻位官能化

Kalvet, Indrek; Deckers, Kristina; Funes-Ardoiz, Ignacio; Magnin, Guillaume; Sperger, Theresa; Kremer, Marius; Schoenebeck, Franziska

Site-Selective, Modular Diversification of Polyhalogenated Aryl Fluorosulfates (ArOSO(2) F) Enabled by an Air-Stable Pd(I) Dimer

利用空气稳定的Pd(I)二聚体实现多卤代芳基氟硫酸酯(ArOSO(2)F)的位点选择性模块化多样化

Mendel, Marvin; Kalvet, Indrek; Hupperich, Daniel; Magnin, Guillaume; Schoenebeck, Franziska

Corrigendum: Rapid Room-Temperature, Chemoselective C sp2 -C sp2 Coupling of Poly(pseudo)halogenated Arenes Enabled by Palladium(I) Catalysis in Air

更正:空气中钯(I)催化实现多(拟)卤代芳烃的快速室温化学选择性Csp2-Csp2偶联

Kalvet, Indrek; Magnin, Guillaume; Schoenebeck, Franziska