Joined January 2021
- Tweets 142
- Following 162
- Followers 162
- Likes 611
13 Photos and videos
7 Oct 2024
"Supporting #HPC centers: Challenges, horror stories and best practices" by Lorenzo D'Amore today at @BSC_CNS, during the #MNHack24: 6th MareNostrum Hackathon
➡️ bsc.es/news/events/mnhack24-…
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11 Jul 2024
Happy to share that starting this week, I have embarked on a new adventure as Computational Scientist at @HPC_Now 💻
I am beyond excited to begin this new chapter joining their awesome and talented team 🚀
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20 May 2024
Sembla que la ciutat s'hagi expressat i Girona no vulgui més botigues de bicis ni cafeteries fent torrades d'alvocat.
Visca els embotits i el comerç local!
@MenysTurismeGi
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15 May 2023
Great to be in Boston at the first @openmsf meeting and finally see all the @openforcefield folks in flesh!
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Lorenzo D'Amore retweeted
11 May 2023
Our OpenFF 2.0 ("Sage") paper is out now at JCIM! pubs.acs.org/doi/10.1021/acs… #compchem
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20 Apr 2023
Honoured to chair the first session of the IQCC30th Anniversary with Dr. Jordi Mestres @jor501mes3 Dr. Ester Masllorens and Dr. Joan Serrano @JoanSP
The chair for session I of #IQCC30years celebration is Dr. Lorenzo D'Amore @_LDAmore
@UdGRecerca @gentudg
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Lorenzo D'Amore retweeted
19 Jan 2023
Our industry-led force field benchmarking paper (relative to QM) is out in JCIM!
19 Jan 2023
Collaborative Assessment of Molecular Geometries and Energies from the Open Force Field @openforcefield
pubs.acs.org/doi/10.1021/acs…
@dotsdl @joshhorton93 @xavierlucas01 @davidlmobley @Ch_Schindler @gtresadern
#vol62 #issue23 #JCIM #compchem
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28 Nov 2022
Happy to see my first paper with @openforcefield picked as ACS editors' choice 🚀🚀🚀
Check out our collaborative benchmark of force fields (#OpenFF, #OPLS #GAFF) against QM using open and proprietary datasets provided by industry partners
dx.doi.org/10.1021/acs.jcim.…
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7 Oct 2022
Ligand-induced change in NMR to guide directed evolution of myoglobin to Kemp-eliminase
5 Oct 2022
It’s been a long journey but we really like how it came out nature.com/articles/s41586-0…
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25 Apr 2022
I enjoyed writing this #OpenFF post about our academic and industrial effort to assess FFs performance! 10 different pharma partners involved, a combined dataset of ~20K drug-like molecules from active research projects or compound collection. Check the results of our benchmark!
22 Apr 2022
📢A new, exciting post by @_LDAmore about collaborative assessment of force field performance (#OpenFF, #OPLS, #GAFF) against QM energies and geometries using open and proprietary datasets provided by our industry partners💙
Read more here openforcefield.org/community…
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17 Feb 2022
You can defend your thesis, but you’re not yet a full Chem PhD without your official @IQCCUdG mug. Thanks folks! 👨🏻🎓❣️🙏🏼
Will aid to stay focused ☕️
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13 Dec 2021
Last Friday I’ve been proclaimed PhD while I was holding my son Aran. It’s hard to describe by words this feeling. Impossible within 280 characters. But I want to express my gratitude to @Marcel_Swart @silviaosu and all the @IQCCUdG folks who contributed to make this happening.
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13 Dec 2021
Extending my deepest gratitude to the tribunal @jeandidiermare1 @vera_krewald and Anna Company. Thank you for such a great discussion!
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Modulation of a mu-1,2-Peroxo Dicopper(II) Intermediate by Strong Interaction with Alkali Metal Ions, by @_LDAmore, @Marcel_Swart and the Franc Meyer group (@ECOSTBio paper), in @J_A_C_S
iqcc.udg.edu/wordpress/2021/…
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Lorenzo D'Amore retweeted
16 Nov 2021
We’ve got a new preprint out on work that led into how we refit LJ parameters for our OpenFF 2.0 Sage release. #compchem
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Lorenzo D'Amore retweeted
8 Nov 2021
I am searching for a motivated PhD student to work on Computational NMR Spectroscopy of heavy transition-metal complexes. The PhD will be hosted at @hylleraas Centre of the University of Oslo. Please RT! Deadline 28 Nov
See more and how to apply: jobbnorge.no/en/available-jo…
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Lorenzo D'Amore retweeted
19 Oct 2021
Modulation of a μ-1,2-Peroxo Dicopper(II) Intermediate by Strong Interaction with Alkali Metal Ions pubs.acs.org/doi/10.1021/jac…
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18 Oct 2021
Thrilled to see it finally out on @J_A_C_S 🚀🚀🚀
Modulation of a μ-1,2-Peroxo Dicopper(II) Intermediate by Strong Interaction with Alkali Metal Ions.
pubs.acs.org/doi/10.1021/jac…
@Marcel_Swart @IQCCUdG
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Lorenzo D'Amore retweeted
6 Oct 2021
New #compchem tutorial: charge displacement analysis based on work by @Marcel_Swart @belp44119997 @_LDAmore scm.com/doc/Tutorials/Analys…
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