AI for Reaction Outcome and Synthetic Route Prediction

AI for Reaction Outcome and Synthetic Route Prediction

When: 9th-11th March  2020

Where: DeVere Totworth Court Hotel, Gloucestershire


Joint meeting between the Dial-a-Molecule, Directed Assembly and AI3SD (Artificial Intelligence and Augmented Intelligence for Automated Investigations for Scientific Discovery) Networks

Scope of meeting.

The meeting will examine the state of the art and future opportunities in the use of Artificial Intelligence to predict the outcome of unknown chemical reactions, and consequently design optimum synthetic routes to desired molecules.
A wide variety of AI approaches will be illustrated, including expert systems, statistical methods, mechanism based and Machine Learning.
The meeting will also consider:
Data sourcing, sharing, and quality.
Automated experimentation to generate reaction knowledge.
Theoretical calculations to enrich or replace experimental data.
As well as talks to introduce the breadth of the area to all participants and plenary lectures from Pierre Baldi, Bartosz Grzybowski and Lee Cronin, we invite you to submit your proposals for oral contributions and posters. The event will also include ample discussion sessions and opportunities to develop collaborations will be a key aspect .

Running from 10:30 on Monday 9th March through to 4pm on Wednesday 11th March, this 3-day event is residential and registration includes 2 nights accommodation and all meals at the lovely De Vere Tortworth Court Hotel.

Registration fees:

Early Bird tickets (to 31st October)   Academia and SMEs £100; Industry Delegates £150
General Admission (from 1st Nov)  Academia and SMEs £200; Industry Delegates £300
To secure your place, register now! More information on the event will be available here.

If you are interested in exhibiting/sponsoring this event please contact us.

All the best,
Richard Whitby and Gill Smith on behalf of the organising committee