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CompChemUvA Profile
CompChemUvA

@CompChemUvA

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

Amsterdam, The Netherlands
Joined February 2022
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@CompChemUvA
CompChemUvA
1 year
join us! #compchem
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@ioana_ilie_UvA
Ioana M. Ilie - @biosim-lab.bsky.social
1 year
The next edition of our online PhD+ seminar series will feature talks by Shrinjay Sharma from @tudelft and Lukas Kรถrber from @Radboud_Uni . Subscribe here to receive the Zoom link: https://t.co/qWw8KGS2am @KNCVchemie @AMOtijs @ChemThanja @IvoFilot @linnleppert
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@CompChemUvA
CompChemUvA
1 year
#compchem group outing!
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@CompChemUvA
CompChemUvA
1 year
And the best presentation price goes to Ashique! Congratulations! ๐ŸŽ‰๐ŸŽŠ #compchem
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@CompChemUvA
CompChemUvA
1 year
More exciting research from our group @HimsUva . Great work from Tamika, Tom, @RanYouri , Maxim and @thorvanheesch #compchem @UvA_Amsterdam
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@CompChemUvA
CompChemUvA
1 year
Two fantastic talks by Massimiliano and Ashique from our group @HimsUva Symposium! Keep up the great work! #compchem @UvA_Amsterdam
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@ioana_ilie_UvA
Ioana M. Ilie - @biosim-lab.bsky.social
2 years
Great work Tom! Fantastic pitch and awesome poster. #proudPI #compchem #DPS2024 @CompChemUvA @HimsUva
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@ioana_ilie_UvA
Ioana M. Ilie - @biosim-lab.bsky.social
2 years
Happy to have contributed to this cool work! Congrats @Canan_Durukann! More peptides coming up๐Ÿฅฐ! #CompChem @TomNGrossmann @jocelyne_vreede @VU_Science @HimsUva @CompChemUvA
@TomNGrossmann
Grossmann Lab
2 years
Now online: Transcription factor-targeting stapled peptides @ChemBioChem We've captured 2 peptide confirmations with crystal structures & used MD simulations to understand the dynamics https://t.co/w7ofx1pjD8 Congrats @Canan_Durukann @ioana_ilie_UvA @jocelyne_vreede @VU_Science
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@CompChemUvA
CompChemUvA
2 years
Congratulations to Tamika on her latest work@
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@CompChemUvA
CompChemUvA
2 years
Itโ€™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
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@ChemCommun
Chemical Communications
2 years
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 ๐Ÿ”“ https://t.co/unG1Q3sfHn
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@ioana_ilie_UvA
Ioana M. Ilie - @biosim-lab.bsky.social
2 years
๐Ÿ”ฌ Happy to announce our latest publication "Unlocking Novel Therapies: Cyclic Peptide Design for Amyloidogenic Targets through Synergies of Experiments, Simulations, and Machine Learning." ๐Ÿ“š #AmyloidogenicTargets #ML #CyclicPeptideDesign https://t.co/DEe6xUyIIY
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@CompChemUvA
CompChemUvA
2 years
Check out the latest work from our group! Congratulations @thorvanheesch #compchem
@thorvanheesch
Thor van Heesch
2 years
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:
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@ioana_ilie_UvA
Ioana M. Ilie - @biosim-lab.bsky.social
2 years
Join us in two weeks for this exciting edition of the KNCV-PhD+ seminars starring @RiccardoReho and Hugo Franca @hybridLinn @IvoFilot @AMOtijs
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@CompChemUvA
CompChemUvA
2 years
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
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@CompChemUvA
CompChemUvA
2 years
Live from the KNCV-CTC-PhD+ symposium, @b_j_mohr presenting her latest great research! #compchem #phdlife
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@PullenSonja
Sonja Pullen
2 years
We @HimsUva are looking for a new staff member in sustainable chemistry! Check out the details:
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@CompChemUvA
CompChemUvA
2 years
Tamika proudly representing #compchem with her awesome research at the @HimsUva Symposium! @UvA_Science
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@ioana_ilie_UvA
Ioana M. Ilie - @biosim-lab.bsky.social
2 years
Kicking off the 2nd @HimsUva symposium! Looking forward! @UvA_Science #Chemistry
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@CompChemUvA
CompChemUvA
3 years
Lots of transition path sampling in one tweet at the Dutch Soft Matter Day in Amsterdam
@ioana_ilie_UvA
Ioana M. Ilie - @biosim-lab.bsky.social
3 years
Wrapping up the Dutch Soft Matter day with an inspiring talk by @CHHDellago @HimsUva @CompChemUvA
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