{"id":2140,"date":"2020-01-06T14:12:53","date_gmt":"2020-01-06T14:12:53","guid":{"rendered":"http:\/\/ukqsar.org\/?p=2140"},"modified":"2020-08-04T13:17:26","modified_gmt":"2020-08-04T12:17:26","slug":"ukqsar-spring-2020-meeting-23rd-april-medicines-discovery-catapult-manchester","status":"publish","type":"post","link":"https:\/\/ukqsar.org\/index.php\/2020\/01\/06\/ukqsar-spring-2020-meeting-23rd-april-medicines-discovery-catapult-manchester\/","title":{"rendered":"UKQSAR Spring 2020 Meeting \u2013 23rd April, Medicines Discovery Catapult, Alderley Park, Manchester"},"content":{"rendered":"\n

You were probably anticipating this, based on the news in the last week, but we can now confirm that the Spring 2020 UKQSAR meeting at Alderley Park has been postponed until the Autumn. More details on that will follow when we have a confirmed date. We are currently looking at online options to discuss science under the UKQSAR umbrella in the Spring and will be in touch in due course regarding this. We’re sorry for the inconvenience this will cause, but we hope to see you in the Autumn.<\/strong><\/p>\n\n\n\n

The Spring UK QSAR & Chemoinformatics Society Meeting will be held at Alderley Park Conference Centre, Cheshire<\/strong><\/p>\n\n\n\n

About this Event<\/h2>\n\n\n\n

The meeting is organised by Andrew Pannifer and colleagues at Medicines Discovery Catapult, Alderley Park, Cheshire.<\/p>\n\n\n\n

If you wish to present a poster, you can submit an abstract during registration.<\/p>\n\n\n\n

Register Here<\/a><\/strong><\/p>\n\n\n\n

How To Get There<\/a><\/strong><\/p>\n\n\n\n

Agenda<\/h2>\n\n\n\n

09:00 – 09:50 Registration with coffee<\/p>\n\n\n\n

Chair, Anna Pallo<\/p>\n\n\n\n

09:50 – 10:00 Introduction<\/p>\n\n\n\n

10:00 – 10:30 Exploiting Reduced Graphs for Molecular Exploration and Exploitation<\/em> – Jess Stacey, University of Sheffield<\/strong><\/p>\n\n\n\n

10:30 – 11:00 AI and automation for drug design<\/em> – Ola Engkvist, AstraZeneca<\/strong><\/p>\n\n\n\n

11:00 – 11:20 Break with coffee<\/p>\n\n\n\n

11:20 – 11:50 Accelerating lead optimisation with Active Learning – joining MMPA ADMET knowledge with Regression Forest machine learning models<\/em> – Al Dossetter, Medchemica<\/strong><\/p>\n\n\n\n

11:50 – 12:20 Leveraging machine learning approaches for target-focused De Novo drug design<\/em> – Charlie Bury, Medicines Discovery Catapult<\/strong><\/p>\n\n\n\n

12:20 – 12:35 Flash poster presentation<\/p>\n\n\n\n

12:35 – 14:00 Lunch and posters<\/p>\n\n\n\n

Chair: Kepa Burusco-Goni<\/p>\n\n\n\n

14:00 – 14:30 Integrating multiparametric high content imaging with machine learning and pathway profiling to inform drug discovery<\/em> – Prof. Neil Carragher, Phenomics Discovery Initiative: University of Edinburgh<\/strong><\/p>\n\n\n\n

14:30 – 15:00 Centaur Chemist\u2122 in 3D: AI powered design of small molecules accelerated by structure-based constraints<\/em> – Catarina Santos, Exscientia<\/strong><\/p>\n\n\n\n

15:00 – 15:20 Break with coffee<\/p>\n\n\n\n

15:20 – 15:50 Enabling the Age of Digital Chemistry<\/em> – Prof. Mimi Hii, Imperial College: Centre for Rapid Online Analysis of Reactions<\/strong><\/p>\n\n\n\n

15:50 – 16:20 Molecular Simulation to Aid Discovery of \u03b1v\u03b26 Integrin Inhibitors<\/em> – Ellen Guest, University of Nottingham<\/strong><\/p>\n\n\n\n

16:20 – 16:25 Poster Prize and close
<\/p>\n","protected":false},"excerpt":{"rendered":"

You were probably anticipating this, based on the news in the last week, but we can now confirm that the<\/p>\n","protected":false},"author":12,"featured_media":0,"comment_status":"closed","ping_status":"closed","sticky":false,"template":"","format":"standard","meta":{"_jetpack_newsletter_access":"","_jetpack_dont_email_post_to_subs":false,"_jetpack_newsletter_tier_id":0,"_jetpack_memberships_contains_paywalled_content":false,"_jetpack_feature_clip_id":0,"_jetpack_memberships_contains_paid_content":false,"footnotes":"","jetpack_post_was_ever_published":false},"categories":[4],"tags":[],"class_list":["post-2140","post","type-post","status-publish","format-standard","hentry","category-meetings"],"aioseo_notices":[],"aioseo_head":"\n\t\t\n\t\n\t\n\t\n\t\n\t\n\t\t\n\t\t\n\t\t\n\t\t\n\t\t\n\t\t\n\t\t\n\t\t\n\t\t\n\t\t\n\t\t\n\t\t