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PODCAST

Under the Surface Podcast

Chemical Computing Group

Under the Surface is a podcast hosted by Chemical Computing Group, where we have in-depth discussions on computer-aided techniques in drug discovery. Chemical Computing Group (CCG) is a leading supplier of computational chemistry and drug discovery software. CCG"s main software platform is the Molecular Operating Environment ("MOE"), which is a single package for visualization, molecular modeling, computer-aided molecular design ("CAMD"), cheminformatics, bioinformatics and methodology development

science chemistry

All Episodes

46:14

12. Never Mind the Woman Behind the Curtain with Dr....

Under the Surface Podcast ·

2025/08/26

In episode 12, Never Mind the Woman Behind the Curtain, we welcome Dr. Sarah Witzke, Senior Application Scientist at CCG, who spills the beans on the not-so-secret life of support scientists in drug discovery. Think of it as a behind-the-scenes tour as to why you shouldn’t ignore the people behind the curtain. Sarah shares her multifaceted journey, hopping from academia to the industry, kind of like a superhero changing outfits—except her cape was probably a lab coat. She unpacks the art of

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01:18:01

11. Crystal Clear: Unveiling the Secrets of...

Under the Surface Podcast ·

2025/06/03

In our next episode, we’re joined by Jason Cole, a Senior Research Fellow at the Cambridge Crystallographic Data Center (CCDC). He shares his fascinating journey, starting from his childhood in Italy, where his love for science blossomed, all the way to his impressive career in computational chemistry and crystallography. We chat about what CCDC does in terms of gathering and sharing crystallographic data, the ups and downs of software development in this field, and why it’s so crucial to validate

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01:04:12

10. The Passport to Knowledge and Discovery

Under the Surface Podcast ·

2025/02/27

In our first episode of 2025, our hosts, Chris Williams and Dave Thompson, have the pleasure of speaking to Fernando Garces, CEO and co-founder of BioGlyph. Leading us from the sunny climes of Portugal through the tropical paradise that is London, on route to the West Coast of the US and A, Fernando shares his evolving love of science through the heights of academia, into industry, and now as CEO of a software company he co-founded to improve the modeling of complex multispecifics. Important

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46:43

9. Rebecca Swett on The Power of Automation in Drug...

Under the Surface Podcast ·

2024/12/19

In our final episode of 2024, host Chris Williams and guest co-host, Under the Surface Executive Producer and CCG Vice President, Alain Deschênes have a long overdue chat with computational drug discovery rock star Rebecca Swett. Rebecca shares her journey from her academic beginnings to her current role at X-Chem, via roles at Novartis, Vertex, and Relay. Rebecca’s wide-ranging experience shines through as the conversation wends its way through cutting-edge computational chemistry covering machine

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42:49

8. The Molecular Assassin

Under the Surface Podcast ·

2024/09/17

On episode 8 of Under the Surface, we’re joined by The Molecular Assassin, Arijit Basu. Arijit describes his journey from India to the US via a transformative sabbatical in Israel. Landing in the Langer lab at MIT and then finding his industrial legs, Arijit turns to computational toxicology as a way to ensure that drug hunters enable the concept of Safety by Design as a core tenant for how they’re navigating chemical space. He doesn’t discuss how he got his cool nickname though, so if that’s what

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45:24

7. On Being The First [Second?]

Under the Surface Podcast ·

2024/08/22

This next episode of Under the Surface has us speaking to crystallographer Eric Larson. In episode 7, as you’ll hear, Eric’s a little nervous about having his thoughts committed to ‘perpetuity.’ But, as you’ll also hear, he does a great job. As our first second structural biologist on the show, he tells us about how he got into the field, the very real logistical challenges of working in industry, and his evocative description of what it feels like to peek ‘behind the veil’ and be the first on the

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01:15:02

6. Revolutionizing Nanoscale Visualization

Under the Surface Podcast ·

2024/04/16

Check out the next episode of our podcast, Under the Surface! In episode 6, Revolutionizing Nanoscale Visualization, we talk to Nanome CEO and co-founder Steve McCloskey. In a virtual rollercoaster of a conversation, he shares Nanome’s scrappy beginnings, the challenge and excitement of bringing new ways of interacting with models to the science community, and paints a vivid picture of an exciting element of the future of molecular modeling. It’s Reality Jim, but not as we know it… Interested in

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01:01:14

5. Farm to Pharma

Under the Surface Podcast ·

2024/01/09

In episode 5, Farm to Pharma, we talk to Dr. Dan McKay about his career in the pharmaceutical industry (he grew up on a Farm! See what we did there … ?). As a pioneer in the applied use of quantum mechanics, Dan describes his break into the industry from academia, his realization of the critical importance of water in understanding ‘what’s going on’, and offers some pointed observations on the applicability of artificial intelligence and machine learning in drug discovery. Throughout our time with

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54:13

4. A CHRIStmas Carol: A Super Special HoliDAVE Edition

Under the Surface Podcast ·

2023/12/21

Welcome to the last episode of the year for our podcast, Under the Surface! In this episode, A CHRIStmas Carol, we conjure up some jovial spirits of the past as our Super Senior co-host Dave grills his colleagues on the founding, early years, and development of the Chemical Computing Group. As you’ll hear, Dave manages to make Research Group Leader, Anna Lin, and his regular co-host, Chris Williams, feel deeply uncomfortable and encourages them to step out of their inherent Canadian humility and

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56:32

3. Instructions for a Life in Science

Under the Surface Podcast ·

2023/11/28

In episode 3, Instructions for a Life in Science, we talk to Dr. Vanita Sood about her experiences as a drug hunter. Vanita candidly shares her career journey, reflecting back on the choices she made, the opportunities and challenges she navigated, and the transformational science she drove. She describes her recent transition from a large pharma company to a startup environment and the critical considerations she’s had to deal with. Throughout we talk about AI in discovery, the science of

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28:27

2. Fun with Pharmacophores

Under the Surface Podcast ·

2023/10/03

Check out the next episode of our podcast, Under the Surface! In episode 2, Fun with Pharmacophores, we talk to Dr. Scott Rowland about pharmacophore-based techniques and their role in understanding receptor–ligand interactions, and ultimately, how they contribute to the design of new drugs. Recently retired, following decades in the pharmaceutical industry, Scott tells us about his journey through the field and his deep appreciation for collaborative science. Scott hasn’t completely hung up his

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28:53

1. Computers to Find Big Molecules

Under the Surface Podcast ·

2023/06/06

In episode 1 of our yet-to-win award podcast, we talk to Dr. Sandeep Kumar, Distinguished Research Fellow in Biotherapeutics at Boehringer Ingelheim about how he uses computers to help develop and deliver biopharmaceuticals and his thoughts on the increasing importance of computational methods in drug discovery. It gets controversial at times, so, you know, just a warning on that. See more: Computational Antibody Discovery: State of the Art:

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11:19

O. Introducing Under the Surface with Chemical...

Under the Surface Podcast ·

2023/06/06

What's this all about, you ask? In today's inaugural episode of our sure-to-be award-winning podcast, we'll cover the who, what, and why we decided to create this podcast. As well as preview industry topics we'll be covering in future episodes. This is not your average science podcast - Welcome to Under the Surface. For more information on Chemical Computing Group, head to: https://www.chemcomp.com/.

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