Great collaboration!! Thanks a lot for the opportunity to work side-by-side with you @filipmiljkovic.bsky.social 🥳👍✨

Filip Miljković@filipmiljkovic.bsky.social · 2mo ago

Our advanced molecular fragmentation algorithm CRUSH is now published in Journal of Cheminformatics. Check it out here: link.springer.com/article/10.1... with @edgarlopez2.bsky.social, @jose-difacquim.bsky.social

🚨 Exciting news! We're editing a Research Topic in @frontiersin.bsky.social Drug Discovery: 📌 "Consensus In Silico Approaches for Drug Discovery & Bioactive Chemical Space Exploration" We warmly invite you to submit your work! 🔬💊 👉 Learn more & submit below. www.frontiersin.org/research-top...

Frontiers | Consensus in Silico Approaches for Drug Discovery and Bioactive Chemical Space Exploration

Recent progress in computational chemistry, machine learning, and bioinformatics has reshaped the landscape of drug discovery, enabling extensive exploration...

frontiersin.org

I invite you to read our latest work where we automated a tool for building constellation plots... an essential tool in Chemoinformatics. 🥳☝️ doi.org/10.1002/minf... Many thanks to Daniel Ramírez and @jose-difacquim.bsky.social for the great teamwork! @wiley.com

Honored to participate in the hybrid #CAiSMD workshop in Cameron, Germany today. Grateful to the organizers and attendees for the insightful discussions on potential collaborations in #ChemicalSpace. A special thank you to Prof. Fidele Ntie-Kang for the warm welcome! #Chemoinformatics #Toxicology

📢 Call for papers! The Pharmaceuticals (MDPI) Special Issue on #chemoinformatics-driven #DrugDiscovery is open. We invite original research & reviews on #AI, data-driven, and systems-level approaches. 👉 Submit here: www.mdpi.com/journal/phar... #Pharmaceuticals @mdpiopenaccess.bsky.social

Huge congratulations to @edgarlopez2.bsky.social garlopez2.bsky.social on earning his PhD and delivering a brilliant defense! It was an honor to co-supervise his work with Dr. Carlos Cerda (CINVESTAV). Wishing him great success in his postdoc at Uppsala University 🎓✨ #PhDDefense #NewPhD

Honored to be part of this great team!! I invite you to read our latest work!! 🥳👍✨

José L. Medina-Franco@jose-difacquim.bsky.social · 7mo ago

Sharing our @chemicalscience.rsc.org review on how #chemoinformatics and bioinformatics are reshaping the #peptide #chemicalspace. Kudos @delafuentelab.bsky.social @edgarlopez2.bsky.social Massyel, Jean-Paul. 👉https://pubs.rsc.org/en/content/articlehtml/2026/sc/d5sc04465k

📢 New article — We construct Network-based Chemical Spaces and applied them to identify novel compounds with anti-S. aureus activity. This method offers a new alternative for discovering bioactive molecules. 🔗https://doi.org/10.3389/fddsv.2025.1724392 @frontiersin.bsky.social

🚀 Paper alert! We present MetAPDB, the 1st open database of approved metal-based drugs, and MetalFP, a new fingerprint family to better represent metal-based compounds for AI and chemoinformatics. 🔗 rdcu.be/eSSNv Thanks to @jose-difacquim.bsky.social for his invaluable support! @springernature.com

I share our work introducing Structure–Property Associations (SPA) — a concept with strong potential in #MedChem and #DrugDesign. Link: doi.org/10.1002/cmdc... Huge thanks to my mentors @jose-difacquim.bsky.social and Karina, who first envisioned this paradigm shift. @chemistryeurope.bsky.social

Honored to share my opinion piece in @chemistryworld.com @rsc.org on the inspiring impact of Lindau Nobel Laureates Meetings for young scientists 🌍🧪 Grateful to @emmapewsey.bsky.social for her kind support! 🙏 #LINO25 #NobelPrize www.chemistryworld.com/opinion/beyo...

Beyond selfies with Nobel laureates

Why young scientists must lead a new era of global collaboration

chemistryworld.com

Very happy to have shared time and space with all the attendees of the 2nd International #EnviroEpiHealth Meeting!! 🌿✨ Many thanks for the warm invitation and kind welcome — I’m sure this marks the beginning of a fruitful collaboration for the benefit of our society! 🙌🤝

Alert of new paper ⚠️🚨 A First-in-Class Discovery: Covalent and ROS-Activated Microtubule Polymerization Inhibitors for a New Era of Selective Anticancer Drugs 💊🥳👉✨ doi.org/10.1111/cbdd... #CovalentDrugs #DrugDesign @wiley.com @jose-difacquim.bsky.social

🌍✨ América Latina brilló en LINO25 ✨🌍 Más de 30 Premios Nobel y 600 jóvenes científicos de todo el mundo se reunieron en la Lindau Nobel Laureate Meeting 2025. Te invito a leer más sobre nuestra participación: lajclinsci.com/vD-6-59 #LINO25

🚀 New publication! “On the Biologically Relevant Chemical Space” BioReCS: A subset of the chemical universe—shaped by active, inactive, and even toxic molecules. 👉 Read more: www.frontiersin.org/journals/dru... #DrugDiscovery #ChemicalSpace #MedChem #AI #Chemoinformatics

Is the chemical space diversifying or just growing?👀👉✨ To answer this question, I invite you to read our latest work! Thanks to @groupquintana.bsky.social and @jose-difacquim.bsky.social for the great collaboration!! #JCIM doi.org/10.1021/acs....

Growth vs Diversity: A Time-Evolution Analysis of the Chemical Space

It is well-known that the number of compounds (both synthesized and theoretical ones) is rapidly increasing. Hence, it would be obvious to affirm that the chemical space is expanding. However, is the ...

doi.org

I feel truly blessed and deeply honored to have been selected as a "Nobel Alumni" at the Lindau Nobel Laureate Meeting 2025 (#LINO25). I am also excited to have had the opportunity to present my research during the "Open Next Generation Science" sessions—it has been an extraordinary experience!