Very happy to release AutoMartiniM3 for Martini3 to automatize CG modelling of small molecules and fragments.
Great work from M Szczuka in my lab in collab with @pauloctsouza.bsky.social and @tbereau.bsky.social teams!
Give it a try: github.com/Martini-Forc...
poke @cg-martini.bsky.social
Great work from M Szczuka in my lab in collab with @pauloctsouza.bsky.social and @tbereau.bsky.social teams!
Give it a try: github.com/Martini-Forc...
poke @cg-martini.bsky.social
June 11, 2025 at 6:49 AM
Very happy to release AutoMartiniM3 for Martini3 to automatize CG modelling of small molecules and fragments.
Great work from M Szczuka in my lab in collab with @pauloctsouza.bsky.social and @tbereau.bsky.social teams!
Give it a try: github.com/Martini-Forc...
poke @cg-martini.bsky.social
Great work from M Szczuka in my lab in collab with @pauloctsouza.bsky.social and @tbereau.bsky.social teams!
Give it a try: github.com/Martini-Forc...
poke @cg-martini.bsky.social
🚀 New preprint out!
"Fast Parameterization of #Martini3 Models for Fragments and Small Molecules" is now on #bioRxiv
👉 doi.org/10.1101/2025...
#AutoMartiniM3 – tool for automated #CG modeling. With @matthchavent.bsky.social, @tbereau.bsky.social and others.
#CoarseGraining #MD #DrugDiscovery
"Fast Parameterization of #Martini3 Models for Fragments and Small Molecules" is now on #bioRxiv
👉 doi.org/10.1101/2025...
#AutoMartiniM3 – tool for automated #CG modeling. With @matthchavent.bsky.social, @tbereau.bsky.social and others.
#CoarseGraining #MD #DrugDiscovery
July 18, 2025 at 10:12 PM
🚀 New preprint out!
"Fast Parameterization of #Martini3 Models for Fragments and Small Molecules" is now on #bioRxiv
👉 doi.org/10.1101/2025...
#AutoMartiniM3 – tool for automated #CG modeling. With @matthchavent.bsky.social, @tbereau.bsky.social and others.
#CoarseGraining #MD #DrugDiscovery
"Fast Parameterization of #Martini3 Models for Fragments and Small Molecules" is now on #bioRxiv
👉 doi.org/10.1101/2025...
#AutoMartiniM3 – tool for automated #CG modeling. With @matthchavent.bsky.social, @tbereau.bsky.social and others.
#CoarseGraining #MD #DrugDiscovery