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T
Thomas Gärtner
machine learning research unit, tu wien informatics, wien m a-1040, austria
26
H指数
282
论文数
4.1K
被引数
0
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14
发表时间
发表时间
IF
被引数
SynCat: molecule-level attention graph neural network for precise reaction classification
SynCat: 分子级注意力图神经网络用于精确反应分类
Digital Discovery
IF
5.6
2025-12-10
0
OA
AI
Phuoc-Chung Van Nguyen; Van-Thinh To; Ngoc-Vi Nguyen Tran; Tieu-Long Phan; Tuyen Ngoc Truong; Thomas Gärtner; Daniel Merkle; Peter F. Stadler
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Interactive Knowledge-Based Kernel PCA for Solvent Selection
基于交互式知识库的溶剂选择核主成分分析
ACS SUSTAINABLE CHEMISTRY & ENGINEERING
IF
7.3
2025-03-14
0
OA
AI
Boobier, S; Heeley, J; Gärtner, T; Hirst, JD
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Reaction rebalancing: a novel approach to curating reaction databases
JOURNAL OF CHEMINFORMATICS
IF
5.7
2024-07-19
2
OA
AI
Phan, Tieu-Long; Weinbauer, Klaus; Gaertner, Thomas; Merkle, Daniel; Andersen, Jakob L.; Fagerberg, Rolf; Stadler, Peter F.
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Depressive symptoms and weight change in inpatients with anorexia nervosa: A cross-lagged panel model
神经性厌食症住院患者的抑郁症状和体重变化: 交叉滞后面板模型
JOURNAL OF PSYCHOSOMATIC RESEARCH
IF
3.3
2023-09-01
1
OA
AI
Meule, Adrian; Kolar, David R.; Gaertner, Thomas; Osen, Bernhard; Rauh, Elisabeth; Naab, Silke; Voderholzer, Ulrich
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Krein support vector machine classification of antimicrobial peptides
DIGITAL DISCOVERY
IF
5.6
2023-01-01
8
OA
AI
Redshaw, Joseph; Ting, Darren S. J.; Brown, Alex; Hirst, Jonathan D.; Gaertner, Thomas
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Kernel Methods for Predicting Yields of Chemical Reactions
JOURNAL OF CHEMICAL INFORMATION AND MODELING
IF
5.3
2021-10-26
34
OA
AI
Haywood, Alexe L.; Redshaw, Joseph; Hanson-Heine, Magnus W. D.; Taylor, Adam; Brown, Alex; Mason, Andrew M.; Gaertner, Thomas; Hirst, Jonathan D.
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Guest editors' introduction to the EcmlPkdd 2016 journal track special issue of Machine Learning
MACHINE LEARNING
IF
2.9
2016-08-03
0
OA
AI
Gartner, Thomas; Nanni, Mirco; Passerini, Andrea; Robardet, Celine
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Introducing the 'active search' method for iterative virtual screening
JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN
IF
3.1
2015-02-01
19
PRE
AI
Garnett, Roman; Gaertner, Thomas; Vogt, Martin; Bajorath, Juergen
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On structured output training: hard cases and an efficient alternative
MACHINE LEARNING
IF
2.9
2009-07-23
14
OA
AI
Gaertner, Thomas; Vembu, Shankar
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Ligand Prediction from Protein Sequence and Small Molecule Information Using Support Vector Machines and Fingerprint Descriptors
JOURNAL OF CHEMICAL INFORMATION AND MODELING
IF
5.3
2009-03-23
51
PRE
AI
Geppert, Hanna; Humrich, Jens; Stumpfe, Dagmar; Gaertner, Thomas; Bajorath, Juergen
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Guest editors' introduction: special issue on mining and learning with graphs
MACHINE LEARNING
IF
2.9
2009-01-17
1
OA
AI
Gaertner, Thomas; Garriga, Gemma C.
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Support-vector-machine-based ranking significantly improves the effectiveness of similarity searching using 2D fingerprints and multiple reference compounds
JOURNAL OF CHEMICAL INFORMATION AND MODELING
IF
5.3
2008-03-05
57
OA
AI
Geppert, Hanna; Horvath, Tamds; Gaertner, Thomas; Wrobel, Stefan; Bajorath, Juergen
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Graph kernels and Gaussian processes for relational reinforcement learning
MACHINE LEARNING
IF
2.9
2006-05-08
36
OA
AI
Driessens, Kurt; Ramon, Jan; Gaertner, Thomas
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Kernels and distances for structured data
MACHINE LEARNING
IF
2.9
2004-12-01
97
OA
AI
Gärtner, T; Lloyd, JW; Flach, PA
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研究方向
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合作学者
合作期刊
P
Peter F. Stadler
H 指数: 119 · 论文数: 1.3K
J
Jürgen Bajorath
H 指数: 76 · 论文数: 1.1K
U
Ulrich Voderholzer
H 指数: 66 · 论文数: 796
A
Adrian Meule
H 指数: 55 · 论文数: 287
J
Jonathan D. Hirst
H 指数: 48 · 论文数: 283
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