Albeiro Restrepo retweeted
Ligand Versatility and Resistance Mechanism of Monotherapy-Grade HIV-1 Protease Inhibitor GRL-142 Binding the Multidrug Resistant Variant p51: Insights from 1 μs MD Simulations
pubs.acs.org/doi/10.1021/acs…
@ccappellichem @AlbeiroARC28 @SaraGomezMaya
#JCIM Vol66 Issue6 #compchem
Beautiful work 👏👏👏
New paper! 🧪
We identify 77 structures of the water octamer and show how hydrogen bond topology drives stability and cooperativity.
Grateful to the team! 👏
@AlbeiroARC28
@AndyDNegra
@SGomezChem
@Juliana26176902
pubs.aip.org/aip/jcp/article…
3
183
Albeiro Restrepo retweeted
New paper in @ChemBioChem!
We provide the mechanistic framework for CHIKV-MXRA8 recognition via a dynamic network of non-covalent interactions. Thanks to the whole team! 👏
@SantiagoAGmez2
@SaraGomezMaya
@ccappellichem
@AlbeiroARC28
@nataandrearojas
chemistry-europe.onlinelibra…
Albeiro Restrepo retweeted
Our @JCIM_JCTC paper uncovers molecular insights into HIV-1 inhibitor GRL-142 high potency. We explain resistance in MDR p51, guiding further optimization. Thanks to the team.
@SaraGomezMaya
@ccappellichem
@JorgeAliTorres
@AlbeiroARC28
@FCENUdeA
pubs.acs.org/doi/10.1021/acs…
This paper may be useful for teaching fundamental thremodynamic concepts using the simple coin toss experiment. Beautiful collaboration with @SaraGomezMaya and my good friend Sergio Lopera. @FCENUdeA @theochemmerida @TptJournal #PapersUdeA
pubs.aip.org/aapt/pte/articl…
Albeiro Restrepo retweeted
Un grupo de científicos colombianos, la mayoría de la @UdeA, descubrieron una nueva molécula.
Por acá la historia del hallazgo y de cómo, según ellos, en Colombia también se puede hacer ciencia de punta:
elespectador.com/ciencia/un-…
@heidyql @JorgeAliTorres
The radical cation of methanol, a deceptively simple molecule, has a puzzling molecular structure an bonding pattern. Read about it in this nice paper just published in JCP.
pubs.aip.org/aip/jcp/article…
Great work by @SGomezChem @JhoanLondoo4. @FCENUdeA
Albeiro Restrepo retweeted
Our latest work in @angew_chem explores planar tetracoordinate oxygen atoms, identifying 35 global minima stabilized by Group 13 elements.
A huge congratulations to @gabyrCT for leading this study
@jbarrozom
@MesiasOrozco
@FOrtizChi
@leyvaluis177
🇲🇽 🇨🇱
onlinelibrary.wiley.com/doi/…
Beautiful art work for this nice paper pubs.rsc.org/en/content/arti… featured in the inside cover of issue 7, Volume 16 of @ChemicalScience. Great collaboration with @JhoanLondoo4 @SGomezChem @heidyql @felipefantuzzi @FCENUdeA
Albeiro Restrepo retweeted
Don't miss Felipe Fantuzzi, Heidy M. Quitián-Lara, Albeiro Restrepo et al's recent article #ChemSciCovers
'More π, please: What drives the formation of unsaturated molecules in the interstellar medium?'
🔗 doi.org/10.1039/D4SC07986H
Albeiro Restrepo retweeted
Este año el Encuentro Nacional de Químicos Teóricos y Computacionales será en la bella ciudad de Cartagena del 28 al 30 de abril. Inscripciones abiertas.
sites.google.com/unal.edu.co…
Albeiro Restrepo retweeted
¡Feliz 2025! Nueva publicación en #astroquímica en colaboración con la @UdeA, el @MPE_Garching, la @UniKent y @liu_universitet. pubs.rsc.org/en/content/arti…
Felicidades a todos, en especial a mi estudiante @JhoanLondoo4, por su 1er paper y su 1er @ChemicalScience #MyFirstChemSci
Why are highly unsaturated molecules so abundant in the ISM of a universe full of hydrogen? Find out in this beautiful paper pubs.rsc.org/en/content/arti… just accepted in @ChemicalScience. Great teamwork with @JhoanLondoo4 @SGomezChem @heidyql @felipefantuzzi
Albeiro Restrepo retweeted
Big shoutout to Jhoan @JhoanLondoo4, Santiago @SGomezChem, Heidy @heidyql, and Albeiro @AlbeiroARC28 for their incredible teamwork! 🇨🇴🇸🇪🇩🇪🇬🇧
Albeiro Restrepo retweeted
Hi @LatinXChem, presenting my work “the water octamer” at #LatinXChem24 #LatinXChemComp #Comp124
Looking forward to your questions and feedback.
Albeiro Restrepo retweeted
Hi @LatinXChem, presenting my work ‘Molecular Dynamics simulations of the Chikungunya virus - cellular receptor complex’ at #LatinXChem24 #LatinXChemComp #Comp135
Albeiro Restrepo retweeted
Hi @LatinXChem, presenting my work “More π please: what drives the formation of unsaturated molecules in Interstellar medium?”. For more information, just follow the thread! [1/12]#LatinXChem24 #LatinXChemComp #Comp083 #Astrochemistry #GasPhase
Albeiro Restrepo retweeted
Hi! @LatinXChem, I present my work “Comparative analysis of the reactivity of cocrystalline intermediates in C-H bond activation reactions mediated by rhodium and iridium” at #LatinXChem24 #LatinXChemComp #Comp085
#DFT #cocryst #Reactivity
Expecting your questions and comments.
Albeiro Restrepo retweeted
The best poster in the entire #LatinXChem competition looks amazing! The Center for Theoretical and Computational Chemistry will cover airfare and local expenses (90 dollars per day) for a week-long visit to @uandresbello. It’s the perfect prize!
We are pleased to announce that #LatinXChem24 is sponsored by the Centro de Química Teórica y Computacional (CQR&C) from @uandresbello . We appreciate your support in this new edition! Visit and register at latinxchem.org
