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

Micellar Solvent Accessibility of Esterified Polyoxyethylene Chains as Crucial Element of Polysorbate Oxidation: A Density Functional Theory, Molecular Dynamics Simulation and Liquid Chromatography/Mass Spectrometry Investigation

酯化聚氧乙烯链的胶束溶剂可及性是聚山梨醇酯氧化的关键因素:密度泛函理论、分子动力学模拟和液相色谱/质谱研究

Weber, Johanna; Pedri, Leonardo; Peters, Luis P; Quoika, Patrick K; Dinu, Dennis F; Liedl, Klaus R; Tautermann, Christofer S; Diederichs, Tim; Garidel, Patrick

Predicting Pharmacokinetics in Rats Using Machine Learning: A Comparative Study Between Empirical, Compartmental, and PBPK-Based Approaches

利用机器学习预测大鼠药代动力学:经验方法、房室模型和基于生理药代动力学(PBPK)方法的比较研究

Walter, Moritz; Aljayyoussi, Ghaith; Gerner, Bettina; Rapp, Hermann; Tautermann, Christofer S; Balazki, Pavel; Skalic, Miha; Borghardt, Jens M; Humbeck, Lina

Estimation of Electrostatic Interaction Energies on a Trapped-Ion Quantum Computer

利用囚禁离子量子计算机估算静电相互作用能

Ollitrault, Pauline J; Loipersberger, Matthias; Parrish, Robert M; Erhard, Alexander; Maier, Christine; Sommer, Christian; Ulmanis, Juris; Monz, Thomas; Gogolin, Christian; Tautermann, Christofer S; Anselmetti, Gian-Luca R; Degroote, Matthias; Moll, Nikolaj; Santagati, Raffaele; Streif, Michael

The challenges and prospects of smooth muscle tissue engineering

平滑肌组织工程的挑战与前景

Baldwin, Christofer S; Iyer, Shilpa; Rao, Raj R

Discovery of a Novel Potent and Selective HSD17B13 Inhibitor, BI-3231, a Well-Characterized Chemical Probe Available for Open Science

发现一种新型强效选择性 HSD17B13 抑制剂 BI-3231,这是一种可用于开放科学且经过充分表征的化学探针

Sven Thamm, Marina K Willwacher, Gary E Aspnes, Tom Bretschneider, Nicholas F Brown, Silke Buschbom-Helmke, Thomas Fox, Emanuele M Gargano, Daniel Grabowski, Christoph Hoenke, Damian Matera, Katja Mueck, Stefan Peters, Sophia Reindl, Doris Riether, Matthias Schmid, Christofer S Tautermann, Aaron M T

BIreactive: Expanding the Scope of Reactivity Predictions to Propynamides

BIreactive:将反应性预测范围扩展到丙酰胺类化合物

Hermann, Markus R; Tautermann, Christofer S; Sieger, Peter; Grundl, Marc A; Weber, Alexander

Reliably assessing the electronic structure of cytochrome P450 on today's classical computers and tomorrow's quantum computers

利用当今的经典计算机和未来的量子计算机可靠地评估细胞色素P450的电子结构

Goings, Joshua J; White, Alec; Lee, Joonho; Tautermann, Christofer S; Degroote, Matthias; Gidney, Craig; Shiozaki, Toru; Babbush, Ryan; Rubin, Nicholas C

Engineering Salt Bridge Networks between Transmembrane Helices Confers Thermostability in G-Protein-Coupled Receptors.

跨膜螺旋间盐桥网络的工程化赋予 G 蛋白偶联受体热稳定性

Ghosh Soumadwip, Bierig Tobias, Lee Sangbae, Jana Suvamay, Löhle Adelheid, Schnapp Gisela, Tautermann Christofer S, Vaidehi Nagarajan

Identifying Functional Hotspot Residues for Biased Ligand Design in G-Protein-Coupled Receptors

识别 G 蛋白偶联受体中的功能热点残基以进行偏向配体设计

Anita K Nivedha, Christofer S Tautermann, Supriyo Bhattacharya, Sangbae Lee, Paola Casarosa, Ines Kollak, Tobias Kiechle, Nagarajan Vaidehi

GPCR structure, function, drug discovery and crystallography: report from Academia-Industry International Conference (UK Royal Society) Chicheley Hall, 1-2 September 2014

GPCR结构、功能、药物发现和晶体学:产学研国际会议报告(英国皇家学会),奇切利庄园,2014年9月1-2日

Heifetz, Alexander; Schertler, Gebhard F X; Seifert, Roland; Tate, Christopher G; Sexton, Patrick M; Gurevich, Vsevolod V; Fourmy, Daniel; Cherezov, Vadim; Marshall, Fiona H; Storer, R Ian; Moraes, Isabel; Tikhonova, Irina G; Tautermann, Christofer S; Hunt, Peter; Ceska, Tom; Hodgson, Simon; Bodkin, Mike J; Singh, Shweta; Law, Richard J; Biggin, Philip C