- 58:38
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53:25
Overcoming challenges in drug metabolism: in silico approaches
Interpreting metabolite-ID experiments; determining the right species for animal studies; providing optimisation suggestions for your medicinal chemistry colleagues to overcome metabolism issues – ...
- 04:11
- 03:17
- 08:24
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09:16
Matched Series Analysis
In this worked example, we use StarDrop's Nova module to identify new derivatives that are likely to improve activity at their target, given the SAR already generated on a project. If you'd like ...
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57:13
How to be a great drug discovery chemist webinar
Do you know what it takes to become a truly great drug discovery chemist? Watch our panel of experts as they discuss tactics to achieve success in your medicinal chemistry projects, experiences th...
- 02:10
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58:21
Integrated prediction of phase I and II metabolism
explore groundbreaking new quantum mechanics and machine learning models which go beyond P450s and provide insights on a broad range of enzymes involved in drug metabolism. Watch as they discuss: ...
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55:41
AI Synthesis Prediction webinar_capt
Synthesis prediction in drug discovery workflows. Learn more about how AI, machine learning and other computational tools can support the discovery process, bringing you feasible synthetic routes t...
- 01:20:35
- 02:29:20
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02:39
StarDrop7.4_HeatMaps
In StarDrop you can display heat maps for the properties contributing to an MPO score. We’ve extended this capability by adding a feature that lets you colour StarDrop data sets based on any proper...
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52:01
Predicting Pharmacokinetics
A real-world case study where we applied deep learning to guide a project, in which potential compounds were displaying good activity profiles but the team wanted to improve their PK profile to ach...
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59:08
FMC webinar
In the face of growing agrochemical resistance and increasingly stringent regulatory requirements, how can AI be harnessed to help lower the costs, failure rates and timelines associated with curre...
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55:33
GenerativeChemistry webinar
Have advances in AI and deep learning reached a threshold whereby generative chemistry methods are redefining drug design? In this webinar, our panel of experts discuss their experiences of meth...
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58:46
Virtual Screening
Virtual screening presents a host of challenges, especially where little or no structural information on targets is available. So how can we best set our screening strategies up for success?
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59:01
CDD Vault and Cerella.mp4
Learn about Cerella’s unique AI methods, see examples of its successful application throughout the drug discovery process and watch a demonstration of how CDD Vault and Cerella connect to seamlessl...
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10:18
Inspyra.mp4
This worked example uses Inspyra™ to interactively explore optimisation strategies to achieve a selective inhibitor of DPP-4 with appropriate physicochemical properties. Starting from a data set of...
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02:51
Inspyra_with_MSA.mp4
In this worked example, we will explore ways to use the Inspyra Panel, in combination with Matched Series Analysis (MSA). MSA goes beyond Matched Pair Analysis and uses longer series of matched com...
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01:09:53
QSAR modelling webinar.mp4
We examine the effective use of QSAR modelling in drug discovery and discuss a variety of pain points for medicinal chemists in knowing when a model can be trusted and how to avoid common pitfalls.
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55:33
AI in early drug discovery.mp4
This panel discuss the state of AI in early drug discovery from hit to preclinical candidate and share their experiences with and expectations of AI, including predictive modelling, synthesis predi...
- 01:50
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55:01
AI solutions webinar 10 May.mp4
AI Solutions from Hit to Candidate – Tackling the challenges of drug discovery data. We explore the highlights of collaborative project results that demonstrate how every phase of the drug discove...
- 02:51
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29:46
StarDrop 7.2 - Inspyra (short).mp4
In this webinar we will demonstrate how Inspyra™ creates a seamless blend of your expertise and unique AI that fits naturally within your workflow. It helps you to rigorously explore many optimisat...
- 52:44
- 03:09
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57:19
Generative Chemistry webinar.mp4
Why have generative chemistry methods not redefined modern drug discovery and compound idea generation? This session will shed light on a typical shortcoming of generative methods related to how to...
- 50:40
- 46:24
- 02:00:40
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56:50
3D Ligand-based drug design.mp4
In this webinar, we demonstrate intuitive workflows for 3D ligand-based drug design, allowing you to; • Enable 3D design, even with little or no target structure information • Find novel active com...
- 12:55
- 01:00:56
- 02:46
- 02:06:04
- 02:55
- 09:30
- 09:44
- 01:39:31
- 35:43
- 02:12:51
- 24:56
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43:40
Data Visualisation.mp4
This webinar looks at how we can use data visualisation in an impactful and effective way to communicate many dimensions of information. We will illustrate some of the ways that we can achieve this...
- 04:32
- 03:12
- 08:37