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General information

Presentation

Nowadays, there is a significant demand for chemists with knowledge of artificial intelligence, data science, automation and cheminformatics. The CAMLC workshop aims to address this demand and provide the new generations of chemists with the necessary knowledge on these topics.

Description

In its third edition, this workshop combines the basics of machine learning, data science and cheminformatics with the most relevant cutting-edge examples in these fields. The topics covered were especially chosen for chemists aiming to learn about these subjects.

Target audience

This workshop is mainly aimed at computational and experimental MSc/PhD students, postdoctoral researchers and university professors working on:

Fields
• Chemical machine learning or cheminformatics
• Computational chemistry
• Organic or inorganic chemistry

Research topics
• Homogeneous or finite systems
• Machine learning modeling and predictions
• Automation of quantum mechanics and machine learning workflows
• Catalyst and ligand design
• High-throughput experimentation
• Drug discovery

Participants are recommended to have basic knowledge of programming or experience with Linux. Additionally, attendees must have a good command of English.

Course format

The program will be delivered in-person through content-based and hands-on sessions.

Workshop certificate

Attendees who fully participate and attend each session will receive a workshop certificate accredited by CSIC.

Director

Juan V. Alegre-Requena

Sponsored by Ministerio de Ciencia, Innovación y Universidades, Agencia Estatal de Investigación, CSIC Aragón, and Digital Discovery (RSC).