CompChemUvA

Computational Chemistry Group @HimsUvA @UvA_Science @UvA_Amsterdam @[email protected]

[CompChemUvA @CompChemUvA]

join us! #compchem

[Ioana M. Ilie - @biosim-lab.bsky.social @ioana_ilie_UvA]

The next edition of our online PhD+ seminar series will feature talks by Shrinjay Sharma from @tudelft and Lukas Körber from @Radboud_Uni .

Subscribe here to receive the Zoom link: https://t.co/qWw8KGS2am

@KNCVchemie @AMOtijs @ChemThanja @IvoFilot @linnleppert

[CompChemUvA @CompChemUvA]

#compchem group outing!

[CompChemUvA @CompChemUvA]

And the best presentation price goes to Ashique! Congratulations! 🎉🎊 #compchem

[CompChemUvA @CompChemUvA]

More exciting research from our group @HimsUva . Great work from Tamika, Tom, @RanYouri , Maxim and @thorvanheesch #compchem @UvA_Amsterdam

[CompChemUvA @CompChemUvA]

Two fantastic talks by Massimiliano and Ashique from our group @HimsUva Symposium! Keep up the great work! #compchem @UvA_Amsterdam

[Ioana M. Ilie - @biosim-lab.bsky.social @ioana_ilie_UvA]

Great work Tom! Fantastic pitch and awesome poster. #proudPI #compchem #DPS2024 @CompChemUvA @HimsUva

[Ioana M. Ilie - @biosim-lab.bsky.social @ioana_ilie_UvA]

Happy to have contributed to this cool work! Congrats @Canan_Durukann! More peptides coming up🥰! #CompChem
@TomNGrossmann @jocelyne_vreede @VU_Science @HimsUva @CompChemUvA

[CompChemUvA @CompChemUvA]

Congratulations to Tamika on her latest work@ https://t.co/GyorkN1et1

[CompChemUvA @CompChemUvA]

It’s a wrap! Two exciting weeks packed with inspiring lectures and tutorials during #MOLSIM! Happy simulating! See you all next year in Amsterdam! @cecamEvents @SmitBerend @BerndEnsing @ioana_ilie_UvA @jocelyne_vreede @HimsUva #DaanFrenkel

[Chemical Communications @ChemCommun]

New Highlight article from @ioana_ilie_UvA and first author Daria de Raffele:

'Unlocking novel therapies: cyclic peptide design for amyloidogenic targets through synergies of experiments, simulations, and machine learning'

#openaccess 🔓

https://t.co/unG1Q3sfHn

[Ioana M. Ilie - @biosim-lab.bsky.social @ioana_ilie_UvA]

🔬 Happy to announce our latest publication "Unlocking Novel Therapies: Cyclic Peptide Design for Amyloidogenic Targets through Synergies of Experiments, Simulations, and Machine Learning." 📚
#AmyloidogenicTargets #ML #CyclicPeptideDesign
https://t.co/DEe6xUyIIY

[CompChemUvA @CompChemUvA]

Check out the latest work from our group! Congratulations @thorvanheesch #compchem

[Thor van Heesch @thorvanheesch]

Super excited to share together with @jocelyne_vreede and Peter Bolhuis my first research paper published in Nucleic Acids Research! We have developed a molecular simulation approach for predicting dissociation free energies of protein-DNA complexes:

[Ioana M. Ilie - @biosim-lab.bsky.social @ioana_ilie_UvA]

Join us in two weeks for this exciting edition of the KNCV-PhD+ seminars starring @RiccardoReho and Hugo Franca @hybridLinn @IvoFilot @AMOtijs

[CompChemUvA @CompChemUvA]

Exciting new paper @compchemUvA! Van 't Hoff et al. employ graph theory to model linoleate biopolymerization yielding experimentally verifiable outcomes. A remarkable leap in understanding complex biochemical processes! #CompChem #Graphtheory #Polymer https://t.co/o8dcYs8Bj8

[CompChemUvA @CompChemUvA]

Live from the KNCV-CTC-PhD+ symposium, @b_j_mohr presenting her latest great research! #compchem #phdlife

[Sonja Pullen @PullenSonja]

We @HimsUva are looking for a new staff member in sustainable chemistry! Check out the details: https://t.co/3zYPxWSWoE

[CompChemUvA @CompChemUvA]

Tamika proudly representing #compchem with her awesome research at the @HimsUva Symposium! @UvA_Science

[Ioana M. Ilie - @biosim-lab.bsky.social @ioana_ilie_UvA]

Kicking off the 2nd @HimsUva symposium! Looking forward! @UvA_Science #Chemistry

[CompChemUvA @CompChemUvA]

@CHHDellago @UvA_Amsterdam @ioana_ilie_UvA @BerndEnsing @apdealbao @HimsUva Happy to have had you here! Looking forward to the next visit!