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

Transferable enantioselectivity models from sparse data

基于稀疏数据的可转移对映选择性模型

Gallarati, Simone; Bucci, Erin M; Doyle, Abigail G; Sigman, Matthew S

Animal-Assisted Activities for Patients with Central Nervous System Disease in Acute Rehabilitation Setting

在急性康复环境中,动物辅助活动对中枢神经系统疾病患者有益

Casati, Vittorio; Re, Valentina; Bardasi, Paola; Contini, Andrea; Cortellazzi, Pilade; Gallarati, Angelica; Bozzini, Emilia; Castignoli, Valentina; Lamberti, Gianfranco; Razza, Fabio; Galante, Simona; Frati, Chiara; Ronchetti, Francesca; Morelli, Monica; Ricci, Emanuela; Ciardi, Gianluca

A genetic optimization strategy with generality in asymmetric organocatalysis as a primary target

以不对称有机催化为主要目标的通用遗传优化策略

Gallarati, Simone; van Gerwen, Puck; Laplaza, Ruben; Brey, Lucien; Makaveev, Alexander; Corminboeuf, Clemence

From Organic Fragments to Photoswitchable Catalysts: The OFF-ON Structural Repository for Transferable Kernel-Based Potentials

从有机片段到光开关催化剂:可转移核基势的OFF-ON结构库

Célerse, Frédéric; Wodrich, Matthew D; Vela, Sergi; Gallarati, Simone; Fabregat, Raimon; Juraskova, Veronika; Corminboeuf, Clémence

OSCAR: an extensive repository of chemically and functionally diverse organocatalysts

OSCAR:一个包含化学和功能各异的有机催化剂的大型数据库

Gallarati, Simone; van Gerwen, Puck; Laplaza, Ruben; Vela, Sergi; Fabrizio, Alberto; Corminboeuf, Clemence

Mapping Catalyst-Solvent Interplay in Competing Carboamination/Cyclopropanation Reactions

竞争性碳胺化/环丙烷化反应中催化剂-溶剂相互作用的映射

Wodrich, Matthew D; Chang, Miyeon; Gallarati, Simone; Woźniak, Łukasz; Cramer, Nicolai; Corminboeuf, Clemence

How Robust Is the Reversible Steric Shielding Strategy for Photoswitchable Organocatalysts?

可逆空间位阻屏蔽策略对光开关有机催化剂的稳健性如何?

Gallarati, Simone; Fabregat, Raimon; Juraskova, Veronika; Inizan, Theo Jaffrelot; Corminboeuf, Clemence

Reaction-based machine learning representations for predicting the enantioselectivity of organocatalysts

基于反应的机器学习表征方法用于预测有机催化剂的对映选择性

Gallarati, Simone; Fabregat, Raimon; Laplaza, Rubén; Bhattacharjee, Sinjini; Wodrich, Matthew D; Corminboeuf, Clemence