Amol Thakkar

6PUBLICATIONS
10CO-AUTHORS
Formal methods for softwareComputational chemistryComputational logic and formal languagesCheminformatics and quantitative structure-activity relationships
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Publications (6)

|Dec 04, 2023
Tools for Synthesis Planning, Automation, and Analytical Data Analysis.

Miruna Cretu, Marvin Alberts, Anubhab Chakraborty

|Aug 02, 2023
Unbiasing Retrosynthesis Language Models with Disconnection Prompts.

Amol Thakkar, Alain C Vaucher, Andrea Byekwaso

|Jun 24, 2021
Retrosynthetic accessibility score (RAscore) - rapid machine learned synthesizability classification from AI driven retrosynthetic planning.

Amol Thakkar, Veronika Chadimová, Esben Jannik Bjerrum

|Jan 12, 2021
Molecular representations in AI-driven drug discovery: a review and practical guide.

Laurianne David, Amol Thakkar, Rocío Mercado

|May 01, 2020
"Ring Breaker": Neural Network Driven Synthesis Prediction of the Ring System Chemical Space.

Amol Thakkar, Nidhal Selmi, Jean-Louis Reymond

|Feb 29, 2020
Datasets and their influence on the development of computer assisted synthesis planning tools in the pharmaceutical domain.

Amol Thakkar, Thierry Kogej, Jean-Louis Reymond

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Frequent Collaborators

3 joint publications

Jean-Louis Reymond

3 joint publications

Ola Engkvist

2 joint publications

Esben Jannik Bjerrum

1 joint publications

Laurianne David