Amol Thakkar

Publication Activity (10 Years)

Years Active: 2019-2023
Publications (10 Years): 5

Top Topics

Subgraph Isomorphism

Chemical Compounds

Heuristic Search Algorithms

Top Venues

Mach. Learn. Sci. Technol.

J. Cheminformatics

ICANN (Workshop)

Publications

Miruna T. Cretu, Alessandra Toniato, Amol Thakkar, Amin A Debabeche, Teodoro Laino, Alain C. Vaucher
Standardizing chemical compounds with language models. Mach. Learn. Sci. Technol. 4 (3) (2023)
Esben Jannik Bjerrum, Amol Thakkar, Ola Engkvist
Artificial applicability labels for improving policies in retrosynthesis prediction. Mach. Learn. Sci. Technol. 2 (1) (2021)
Laurianne David, Amol Thakkar, Rocío Mercado, Ola Engkvist
Molecular representations in AI-driven drug discovery: a review and practical guide. J. Cheminformatics 12 (1) (2020)
Samuel Genheden, Amol Thakkar, Veronika Chadimová, Jean-Louis Reymond, Ola Engkvist, Esben Jannik Bjerrum
AiZynthFinder: a fast, robust and flexible open-source software for retrosynthetic planning. J. Cheminformatics 12 (1) (2020)
Amol Thakkar, Esben Jannik Bjerrum, Ola Engkvist, Jean-Louis Reymond
Neural Network Guided Tree-Search Policies for Synthesis Planning. ICANN (Workshop) (2019)