E. Daiann Sosa Carrizo

Assistant Professor at @UT3PaulSabatier University - @LPCNO_ - @INSAToulouse
💻 Studying bond nature & reactivity using DFT and Machine Learning

[E. Daiann Sosa Carrizo @SCDaiann]

Glad to see this collaborative work with Sébastien Vidal and Marie Sircoglou now out. Congratulations to all the authors.
Open access: 10.1002/ceur.202500477 #Chemistry #Catalysis #dft

[RSEQ @RSEQUIMICA]

📙Investigación Química | El modelo Push-Pull como estrategia de activación y estabilización molecular. #Analesdequímica
✍️Helena Corona, Nereida Hidalgo, Marina Pérez-Jiménez, Felipe de la Cruz-Martínez, Jesús Campos.
➡️https://t.co/WRxZ253I2E

[E. Daiann Sosa Carrizo @SCDaiann]

Glad to have participated in the NanoX Fermi Days.
Great discussions on, electronic structure, and computational approaches.

#NanoX #FermiDays #ComputationalChemistry #DFT

[The Nobel Prize @NobelPrize]

BREAKING NEWS
The Royal Swedish Academy of Sciences has decided to award the 2025 #NobelPrize in Chemistry to Susumu Kitagawa, Richard Robson and Omar M. Yaghi “for the development of metal–organic frameworks.”

[Dr. Mikhail V. Polynski @630_5th_Ave]

Our book with @AnanikovLab is in final production (even pre-orders are open). With contributions from @reid_indeed, @thijsstuyver, @HESauceda, @TheAlegreGroup, @kjelljorner, and many others.
#AI #Catalysis #MachineLearning #ML #CatalystDesign #CompChem

[Chemical Communications @ChemCommun]

As part of our support of @LatinXChem, we're delighted to share this #OpenCall for a collection celebrating chemistry from across Latin America!

Find out more, including participating journals and how to submit, on our blog 👉 https://t.co/TqUuFdmkIv

[SYNLETT Journal @synlett_journal]

Catalytic breakthrough🧪 Dirhodium(II) tetracarboxylates enable selective C(sp³)–H #amination, avoiding benzylic C–H bonds. @Marie_Sircoglou, P. Dauban, and co-workers open doors for new amine synthesis methods!
#rhodiumcatalysis
Read more 👉https://t.co/67wuG10fCp

[Miquel Solà @miquelsola]

En el último número de @analesdequimica podéis encontrar unas "Reflexiones en torno a la gestión de los grupos de investigación" sobre las que podéis estar más o menos de acuerdo. #openaccess https://t.co/tRjcwxj8gs

[E. Daiann Sosa Carrizo @SCDaiann]

@miquelsola @analesdequimica Gracias, Miquel! No conocía el efecto Pigmalión, pero ahora se que marcó mi PhD, donde el ejemplo del PI convirtió lo imposible en factible. Qué particular reflexión en tiempos de individualistas y acelerados. Creo como usted que reconocimiento mutuo impulsan el verdadero avance.

[IQCC UdG @IQCCUdG]

Check our latest work about [4+2]-Cycloaddition Reactions to Corannulene Accelerated by η6-Coordination of Ruthenium Complexes by @miquelsola
@Yago_GRN in collaboration with A Lebcir, A Boukhari in @ChemEurope

#IQCCpaper @DIMOCAT_iqcc @UdGRecerca

https://t.co/wz0xjl97Gx

[E. Daiann Sosa Carrizo @SCDaiann]

@MaserasGroup @ed_ssan @DFT2024 Congratulations !!!

[Top Science @isciverse]

Promises and Perils of Big Data: Philosophical Constraints on Chemical Ontologies

@J_A_C_S #Chemistry #Chemed #Science #TechnologyNews #news #technology #AcademicTwitter #AcademicChatter

https://t.co/gfmIJ3qIi2

[CBOND2024 @CBOND2024]

📣 We are delighted that @SCM_Amsterdam will generously sponsor the Young Researcher Symposium of @CBOND2024! 🧪💻

For young researchers — organized by young researchers. 👩‍🔬👨‍🔬👩‍💻👨‍💻

Please RT to get the word out to Ph.D. students interested in chemical bonding!🔥

[Tanguy Saget @TanguySaget]

Bonjour, notre équipe est à la recherche d'un étudiant de M2 souhaitant postuler pour une bourse de thèse de l'ED 2MIB de Paris-Saclay afin d'effectuer un doctorat à l'ICSN dans le domaine de la catalyse énantiosélective et de l'amination C-H intermoléculaire. Merci de RT!

[Enzo Ferrante @enzoferrante]

We made it to the cover of Nature Machine Intelligence @NatMachIntell !

Congrats @rodbonazzola @affrangi and team!

If you are interested in imaging genetics and how to discover new phenotype-genotype associations for anatomy, check it out: https://t.co/nqksOurSj6

👇

[E. Daiann Sosa Carrizo @SCDaiann]

Delighted to share our collaborative research with the Dauban and @Marie_Sircoglou teams, recently published in JACS! 📚 Our study unveils Catalyst-Controlled Homobenzylic C(sp3)-H Amination. Congrats @BrunardErwan, @TanguySaget! #MyFirstCorrspJACS

[J. Am. Chem. Soc. @J_A_C_S]

Intermolecular Homobenzylic C(sp3)–H Amination for Synthesis of β-Arylethylamines | Journal of the American Chemical Society @SCDaiann @UnivParisSaclay @Marie_Sircoglou @CNRS @ICSN_lab @TotalSyntheses #Catalysis #Homobenzylic #CHAmination #Amines https://t.co/PGpERnLHPG

[E. Daiann Sosa Carrizo @SCDaiann]

The trip 'Between Abstract Mathematics and Applied Sciences,' quoting @Sergei_Imaging's insights, is inspiring. I leverage simulations to disclose catalyst complexities, connecting quantum mechanics with real applications. Kalinin's pic encapsulates the essence. #Chemistry🧑‍💻🧑‍🔬

[Mykhailiuk Chem 🇺🇦 @MykhailiukChem]

We love to increase the repertoire of saturated benzene bioisosteres for medchemists! Today in @angew_chem: https://t.co/RvPVmEsXcQ

[Gabriel Rabinovich @gabyrabi]

Brillante artículo publicado en ⁦@NaturePortfolio⁩ de la gran científica Ruth Lehmann, Directora del Whitehead Institute:“ La ciencia básica, creativa es el motor fundamental de cualquier desarrollo farmacéutico y tecnológico y debe ser apoyada en un escenario democratico”

[J. Am. Chem. Soc. @J_A_C_S]

📈 Read one of our most read #OpenAccess articles, "Dearomative syn-Dihydroxylation of Naphthalenes with a Biomimetic Iron Catalyst".

Find out more here ➡️ https://t.co/mV6n00Vnjp