Open-source drug discovery software: It’s free, right?
When are open-source drug discovery solutions a good fit? We should first clarify that when we’re speaking about open-source tools,…
When are open-source drug discovery solutions a good fit? We should first clarify that when we’re speaking about open-source tools,…
No glove fits every hand perfectly—and it’s the same with software tools. There’s no one-size-fits-all solution when it comes to…
Introduction 3D molecular modelling plays a vital role in modern drug discovery, offering powerful applications to streamline research, reduce costs,…
What value does AI offer in drug discovery? The potential is huge: To learn more about the value we’re seeing…
ChatGPT can be great for the basics, but cannot replace expert human knowledge I’m going to quickly discount the most…
Introduction In early-stage drug discovery, medicinal chemists rely on predictive models to help guide which compounds to synthesise or test…
Defining value is the best place to start Before diving into the specifics of testing AI’s value, the first step…
When evaluating any new technology, it is important to establish how you will validate whether it will deliver a return…
Imagine you’re trying to find the correct key to unlock a treasure box, but there are billions of keys to…
What is Derek Nexus? Developed by Lhasa Limited, Derek Nexus is an expert-knowledge based system that draws on over 40…
How can I predict my compound’s absorption? The first of the ADMET properties relate to absorption. Understanding how a drug…
Which AI platform do you need? The first thing you’ll need to do is decide what you need to achieve…
What are StarDrop and Semeta? Semeta is a tailored platform for DMPK scientists. It enables users to address key challenges…
What comprises large molecules? When we talk about “large molecules,” we often think of biologics like monoclonal antibodies, proteins, and…
StarDrop — A Swiss Army knife for drug discovery It’s designed to fit right in with the other tools you…
At a very basic level, this means that StarDrop supports loading data from many different standard file formats (SDF, MOL2,…