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@martinvoegele.bsky.socialSep 9, 2026, 5:32 PM

Now published: We used FEP to classify integrin-binding ligands as "opening" or "closing" which can help design safe small-molecule inhibitors as potential new therapeutics.
doi.org/10.1021/jacs...

#Science #Integrin #DrugDiscovery #CompChem 👨‍💻🧪⚗

A Table of Contents (TOC) graphic illustrating the conformational preference classification of integrin-binding ligands. The left panel shows a thermodynamic cycle where a green ligand binds to a blue "closed integrin" with a free energy of Delta-G closed, or to an orange "open integrin" with a free energy of Delta-G open. A horizontal arrow with a question mark represents the conformational transition between the ligand-bound states, governed by the difference of binding affinities to the respective states. The right panel features a scatter plot ranking ligands along an energy axis from -50 to -10 kcal/mol. A dashed vertical boundary at roughly -18 kcal/mol separates the molecules into two distinct groups based on their conformational impact: "opening ligands" depicted as orange circles at lower energy values, and "closing ligands" depicted as blue squares at higher energy values.
@markfortner.bsky.socialSep 9, 2026, 5:30 PM

Give us 10 minutes and we'll show you how Digital Transformation with AI and Automation can change your drug discovery operations.

bit.ly/4blEtN6

#DrugDiscovery #DigitalTransformation #AI #automation.

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@aspenbio.bsky.socialSep 9, 2026, 5:15 PM

Give us 10 minutes and we'll show you how Digital Transformation with AI and Automation can change your drug discovery operations.

bit.ly/4blEtN6

#DrugDiscovery #DigitalTransformation #AI #automation.

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@piellab.bsky.socialSep 9, 2026, 2:02 PM

We found the uncultivated bacterium producing the anticancer drug candidate peloruside A and hiding in an NZ sponge!
It uses a new biochemical trick in complex polyketide biosynthesis.
Congrats Amy, our Victoria University NZ collaborators, and the whole team!
#DrugDiscovery

@medinadiscovery.bsky.socialSep 9, 2026, 1:36 PM

GC ADDA H3D Foundation #RAFIKI #EUOPENSCREEN #DrugDiscovery #NaturalProducts #GlobalHealth #AfricaScience #ResearchTraining #EarlyCareerResearchers

@annualreviews.bsky.socialSep 9, 2026, 12:48 PM

Tomorrow's breakthrough treatments may come from drugs we use now. How is AI using genomics and multiomics data to support drug discovery?

🔗 Freely available thanks to S2O: arevie.ws/45wyEca
✨New to our AI, Machine Learning, and Society collection

#MachineLearning #DrugDiscovery

Figure from the article depicting the process of how to repurpose drugs.
@fiosgenomics.bsky.socialSep 9, 2026, 10:50 AM

Not sure about the steps involved in the Preclinical Phase of drug development? This video explains what happens at each stage, from #drugdiscovery to #toxicology! ▶️
https://youtu.be/5Z5jh02KxkY?feature=shared
#preclinicalresearch #drugdevelopment #bioinformatics

@prof-clark.bsky.socialSep 9, 2026, 9:00 AM

AI may transform AMD drug discovery, but algorithms generate hypotheses, not biological proof. Validation, generalisability and mechanism remain the real tests. #AI #AMD #DrugDiscovery buff.ly/9wRiLTr

@markfortner.bsky.socialSep 8, 2026, 9:30 PM

Got 8 minutes? Let us show you how the Pipeline Drug Discovery platform can transform your research operations, reduce risk & costs, and improve collaboration.

Contact us at [email protected]

bit.ly/4uuHNwV

#DrugDiscovery #AI #Assays #PM #Chem #ProteinProduction #TargetManagement

@aspenbio.bsky.socialSep 8, 2026, 9:12 PM

Got 8 minutes? Let us show you how the Pipeline Drug Discovery platform can transform your research operations, reduce risk & costs, and improve collaboration.

Contact us at [email protected]

bit.ly/4uuHNwV

#DrugDiscovery #AI #Assays #PM #Chem #ProteinProduction #TargetManagement

@gmj-georgia.bsky.socialSep 8, 2026, 8:41 PM

Eli Lilly has invested in Absci, an AI biotech startup developing novel hair loss treatments that could reshape dermatological care. The… #Artificialintelligence #Drugdiscovery #EliLilly #Hairlosstreatment #Pharmaceuticalinnovation #Artificialintelligence #Drugdiscovery #EliLilly #Hairlosstreat…

@aspenbio.bsky.socialSep 8, 2026, 4:31 PM

At Aspen Biosciences, we provide drug discovery companies with the tools they need to create new medicines. To learn more, visit us at bit.ly/3CtV2VC or contact us at [email protected]

#informatics #DrugDiscovery #AI

@markfortner.bsky.socialSep 8, 2026, 4:31 PM

At Aspen Biosciences, we provide drug discovery companies with the tools they need to create new medicines. To learn more, visit us at bit.ly/3CtV2VC or contact us at [email protected]

#informatics #DrugDiscovery #AI

@protifi.bsky.socialSep 8, 2026, 4:07 PM

Join us at Booth 14 at the CASSS Mass Spec Symposium next week to discover how ProtiFi™ can reduce your method development processes with a standardized MAM workflow in drug discovery and QC environments. See you there!

#ProtiFi™ #MAM #DrugDiscovery #Biopharma #Biotech #Innovation

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@imerit.bsky.socialSep 8, 2026, 3:03 PM

AI is advancing drug discovery, but Phase II success remains 40% vs. 80–90% in Phase I.

The gap? Thin translational data and limited expert scientific reasoning. See how iMerit Scholars helps bridge the gap between prediction and outcomes:
imerit.ai/resources/bl...

#MedicalAI #DrugDiscovery

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@ertrunnell.bsky.socialSep 8, 2026, 12:25 PM

💡 @fda.gov should establish a similar pathway.

The U.S. is a global leader in #biotech.

Making data from these methods easier to share could help connect discoveries from academic labs with medicine developers and strengthen the scientific foundation of #drugdiscovery.

@kuglerelisabeth.bsky.socialSep 8, 2026, 9:11 AM

We also looked ahead to the future of AI, the changing needs of scientific professionals, and what the next 20 years could bring.

🎥 Watch our full interview: youtu.be/xIbgXVyGrNw

Register for Drug Discovery 2026: elrig.org/portfolio/dr...

#KeepItScience #DrugDiscovery #ELRIG #CRISPR #ELRIGDD26

@newsmedical.bsky.socialSep 8, 2026, 4:47 AM

🦂 Could scorpion venom hold the key to new liver disease therapies? See how its peptides are being explored for anti-inflammatory and antiviral effects. www.news-medical.net/news/2026090... #ScorpionVenom #LiverDisease #Biotech #DrugDiscovery

@aging-us.bsky.socialSep 8, 2026, 2:00 AM

Aging is pleased to announce that we are a media partner of the 13th Aging Research & Drug Discovery Meeting (ARDD), taking place October 1–3 at Harvard University in Boston, MA.

🔗 Learn more:
https://bit.ly/3UfNcue

#Aging #ARDD #Research #DrugDiscovery #Longevity #Harvard

@markfortner.bsky.socialSep 7, 2026, 9:30 PM

Early Data Indicates an AI-generated Drug Could Slow Aging | #AI #DrugDiscovery #aging #InsilicoMedicine