@Lmoranglez

Currently at @hylleraas 💻 PhD in #compchem at @MaserasGroup | From 🦁

Joined April 2019
  • Tweets199
  • Following386
  • Followers226
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Lucía Morán retweeted
Heidi Klem@HeidiKlem2 Jul 2025
The Klem Lab at LSU is hiring a postdoctoral researcher in computational biochemistry! Application info: klem-research-group.github.i… ♻️ Please share with anyone who might be interested! #chemjobs #postdoc #compchem #biochemistry #enzymes
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Lucía Morán retweeted
ioChem-BD@ioChem_BD16 May 2025
Shoutout to our users in @UniOslo! We will have a stall at WATOC 2025 #Oslo, by the way, come meet us in person!
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Lucía Morán retweeted
Mariola Tortosa@TortosaLab8 Jun 2025
Last few weeks to apply for a PhD position in our group within the MSCA Doctoral Network CATALOOP. If you are interested in asymmetric catalysis and data-driven chemistry don’t miss this opportunity! | EURAXESS euraxess.ec.europa.eu/jobs/3…
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🚀 From mechanistic insights to inverse catalyst design, our new Perspective maps the breakthroughs — and the hurdles ahead — in AI for homogeneous catalysis with transition metal complexes. Take a peek! 👀 @BalcellsD @hylleraas pubs.acs.org/doi/10.1021/acs…

AI Approaches to Homogeneous Catalysis with Transition Metal Complexes

Abstract. Artificial intelligence (AI) is transforming research in chemistry, including homogeneous catalysis with transition metals. Over the past 15 year

pubs.acs.org
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Lucía Morán retweeted
David Balcells@BalcellsD24 Apr 2025
Now out in JACS Au, our inverse design model for transition metal chemistry, supporting generative tasks conditioned by ligand and metal complex properties. We implemented dual-objective generation and it was fascinating to see navigation in latent space! pubs.acs.org/doi/10.1021/jac…

A Deep Generative Model for the Inverse Design of Transition Metal Ligands and Complexes

Abstract. Deep generative models yielding transition metal complexes (TMCs) remain scarce despite the key role of these compounds in industrial catalytic p

pubs.acs.org
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jobbnorge.no/en/available-jo… @hylleraas
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Lucía Morán retweeted
Arjan W. Kleij@KLEIJ_ICIQ24 Mar 2025
URGENT: the @KLEIJ_ICIQ team at @ICIQchem 🇪🇸 is looking for a PhD candidate with immediate availability (meaning no EU Visa restrictions), targeted start date Jun-Jul’25, contact [email protected], only serious applications 🙏 will be considered and answered. RTs appreciated 🤩
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Lucía Morán retweeted
ioChem-BD@ioChem_BD24 Mar 2025
🆕🆕🆕 We have a new website: iochem-bd.com There you can discover the main features of our software and create an account for free. This is our new contact form: iochem-bd.com/contact.html?o…
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Lucía Morán retweeted
Enric Petrus@Enric_Petrus20 Mar 2025
Happy to share our recent preprint article on @ChemRxiv about applying automated reaction network explorations of oxidative processes in water 💻 doi.org/10.26434/chemrxiv-20… @EawagResearch @ETH_en #compchem

Automated Reaction Exploration of Ozonation Processes for Model Olefins in Water | ChemRxiv

The comprehensive evaluation of pollutant abatement during chemical oxidation processes and identification of potentially hazardous transformation products are a fundamental challenge in water and...

chemrxiv.org
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Happy to share that I've been granted a MSCA fellowship🌞 Thanks for the support @hylleraas !
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Lucía Morán retweeted
QuimComp@CompQuim18 Jan 2025
Abierto el plazo de aplicación para asistir a la segunda edición del curso Cheminformatics, Automation and Machine Learning in Chemistry: from fundamental concepts to emerging techniques (CAMLC), que tendrá lugar en Zaragoza del 16 al 19 de septiembre. camlcworkshop.github.io.

CAMLC

camlcworkshop.github.io
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📢 Applications open to join the second edition of the CAMLC workshop, a great opportunity for chemists who want to learn about cheminformatics, automation, and machine learning. September 16-19 in Zaragoza, Spain. 🗓️ Application deadline: February 28 👉🏻 camlcworkshop.github.io/
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Lucía Morán retweeted
Carles Bo@Carles_Bo16 Dec 2024
NEWS !! NEWS !! 3 years job offer. Postdoctoral Researcher. ⁦@ICIQchem⁩ ⁦@iCERCA⁩ ⁦ careers.iciq.org/jobs/534878…
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AABBA Graph Kernel: Atom-Atom, Bond-Bond, and Bond-Atom Autocorrelations for Machine Learning pubs.acs.org/doi/10.1021/acs… @hkneiding_ @BalcellsD #JCIM Vol64 Issue23 #MachineLearning #DeepLearning

AABBA Graph Kernel: Atom-Atom, Bond-Bond, and Bond-Atom Autocorrelations for Machine Learning

Abstract. Graphs are one of the most natural and powerful representations available for molecules; natural because they have an intuitive correspondence to

pubs.acs.org
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Lucía Morán retweeted
Kjell Jorner@kjelljorner10 Dec 2024
Another chance to join our group! We are recruiting a PhD student in digital ligand engineering for nanocatalysis. Reposts and spreading the word to interested people in your network appreciated! jobs.ethz.ch/job/view/JOPG_e…
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Interested in doing a PhD/Postdoc in #compchem in Spain? Come and join us! Applications for regional funding are already open (see details below):
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Lucía Morán retweeted
NordCO2@NordCO226 Nov 2024
🌟 Exciting News! 🌟 Join us in Oslo for a symposium on #SustainableChemistry! 📅 Date: 13th December 2024 📍 Venue: UiO 📢 Registration: nettskjema.no/a/454537 #GreenInnovation #CircularEconomy #NordicCollaboration #RecyclingTechnologies #CO2Utilization
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Lucía Morán retweeted
Gabriel
@gabelbling26 Oct 2024
Amazing graphical representation of a neural net, never seen anything like it.
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Lucía Morán retweeted
ICIQ@ICIQchem11 Sep 2024
#ICIQWomeninScience 🟣Meet Marina Díaz (@mdiazru), a #PhD student at @Maserasgroup ➡️With an FPI Fellowship, she's advancing electrosynthetic reactions using computational methods 🙋‍♀️Join us at ICIQ as we celebrate #womeninSTEM every day! @CienciaGob @AgEInves @iCERCA
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Lucía Morán retweeted
ICIQ@ICIQchem2 Sep 2024
#ICIQCalendar September 💻Computational treatment of inorganic and organic chemical structures 📸 Diego Garay, Lucía Moran (@Lmoranglez) and Marina Díaz (@mdiazru) from @HartreeFoca and @MaserasGroup @iCERCA @_BIST @SOMM_alliance
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