Giulia Palermo Lab at the University of California, Riverside. Biophysicist passionate about Science & Art! In love with Nucleic Acids and Computational Science!
We revea, how TnsC filaments form and grow in #CRISPR-associated transposons using #FreeEnergy sims & introduce #DeepLearning-based Graph Attention Networks for decoding biomolecular systems!
www.biorxiv.org/content/10.1...
#GNN #MolecularDynamics #StructuralBiology
Grateful to my amazing students, postdocs, colleagues @UCR, collaborators, and mentors.
A new chapter begins, advancing #compchem, #AI to explore #RNA, #DNA, #CRISPR, and emerging directions in #Biophysics.
Grateful to my amazing students, postdocs, colleagues @UCR, collaborators, and mentors.
A new chapter begins, advancing #compchem, #AI to explore #RNA, #DNA, #CRISPR, and emerging directions in #Biophysics.
ParametrizANI brings #MachineLearning - based #ForceField parametrization available to everyone
Available on Github: github.com/palermolab/P...
Our paper is now published in JCIM!
Making ML-based force field parametrization open and easy for everyone.
With TorchANI, @rdkit.bsky.social & @openmm.org
🔗 pubs.acs.org/doi/abs/10.1...
@acs.org @giuliapalermo.bsky.social
ParametrizANI brings #MachineLearning - based #ForceField parametrization available to everyone
Available on Github: github.com/palermolab/P...
www.sdsc.edu/news/2025/PR...
#Supercomputing #HPC #CRISPR #RNA #CompChem
www.sdsc.edu/news/2025/PR...
#Supercomputing #HPC #CRISPR #RNA #CompChem
Guess who got picked...
♥️♥️♥️
#biophysics #TeachingJoy #STEM #LoveScience
Guess who got picked...
♥️♥️♥️
#biophysics #TeachingJoy #STEM #LoveScience
We reveal a cryptic metal binding pocket that dinamically forms in #CRISPR-Cas9 and regulates the metal-dependent activity of #Cas9.
#MarkovModels & #QuantumChemistry corroborated by biochem & #NMR experiments.
www.biorxiv.org/content/10.1...
We reveal a cryptic metal binding pocket that dinamically forms in #CRISPR-Cas9 and regulates the metal-dependent activity of #Cas9.
#MarkovModels & #QuantumChemistry corroborated by biochem & #NMR experiments.
www.biorxiv.org/content/10.1...
🚀 ParametrizANI - a #NeuralNetworks tool for molecular parametrization.
Predicts potential energy surfaces with near-DFT/CC accuracy, at a fraction of the computational cost!
#AI #QuantumChemistry #CompChem #ML 🤖
chemrxiv.org/engage/chemr...
Try it:
github.com/palermolab/P...
🚀 ParametrizANI - a #NeuralNetworks tool for molecular parametrization.
Predicts potential energy surfaces with near-DFT/CC accuracy, at a fraction of the computational cost!
#AI #QuantumChemistry #CompChem #ML 🤖
chemrxiv.org/engage/chemr...
Try it:
github.com/palermolab/P...
We revea, how TnsC filaments form and grow in #CRISPR-associated transposons using #FreeEnergy sims & introduce #DeepLearning-based Graph Attention Networks for decoding biomolecular systems!
www.biorxiv.org/content/10.1...
#GNN #MolecularDynamics #StructuralBiology
We revea, how TnsC filaments form and grow in #CRISPR-associated transposons using #FreeEnergy sims & introduce #DeepLearning-based Graph Attention Networks for decoding biomolecular systems!
www.biorxiv.org/content/10.1...
#GNN #MolecularDynamics #StructuralBiology
Using free energy simulations, #AIphaFold and #cryoEM refinement, we uncovered a key conformational change in a paradigm-shifting #CRISPR-associated #transposon capable of precise gene knock-ins. 🔍🧬
www.pnas.org/doi/epub/10....
Using free energy simulations, #AIphaFold and #cryoEM refinement, we uncovered a key conformational change in a paradigm-shifting #CRISPR-associated #transposon capable of precise gene knock-ins. 🔍🧬
www.pnas.org/doi/epub/10....
#compchem #RNA
#compchem #RNA
🧬 @Ahsan09966804 showcases how #MolecularDynamics & #AI can enhance #CryoEM map refinement.
📍 Catch it at Board 18 (1824-Pos) today, don’t miss out! #Biophysics #CompBio
🧬 @Ahsan09966804 showcases how #MolecularDynamics & #AI can enhance #CryoEM map refinement.
📍 Catch it at Board 18 (1824-Pos) today, don’t miss out! #Biophysics #CompBio
Don’t miss her poster today L3074-Pos (LB13). She’s looking for a postdoc, and I have no doubt she’ll thrive!
Don’t miss her poster today L3074-Pos (LB13). She’s looking for a postdoc, and I have no doubt she’ll thrive!
Read our papers to know more:
www.nature.com/articles/s41...
www.biorxiv.org/content/10.1...
Read our papers to know more:
www.nature.com/articles/s41...
www.biorxiv.org/content/10.1...
This is work by Kazi Hossain, an incredibly talented student visiting my lab from the Czub lab, now in Orozco's lab & Lukasz Nierzwicki.
doi.org/10.7554/eLif...
This is work by Kazi Hossain, an incredibly talented student visiting my lab from the Czub lab, now in Orozco's lab & Lukasz Nierzwicki.
doi.org/10.7554/eLif...
We reveal the dynamics and mechanism of target DNA traversal in #CRISPR Cas12a, a conundrum in the field!
nature.com/articles/s41...
#compchem
We thank the amazing #HPC resources of PSC #Anton2 and SDSC
We reveal the dynamics and mechanism of target DNA traversal in #CRISPR Cas12a, a conundrum in the field!
nature.com/articles/s41...
#compchem
We thank the amazing #HPC resources of PSC #Anton2 and SDSC
Audrey Lapinaite!
@narjournal.bsky.social
The dimerization of TadA8e and its exclusive interactions with #CRISPR Cas9 boost #BaseEditing efficiency!
academic.oup.com/nar/article/...
Audrey Lapinaite!
@narjournal.bsky.social
The dimerization of TadA8e and its exclusive interactions with #CRISPR Cas9 boost #BaseEditing efficiency!
academic.oup.com/nar/article/...