Cheminformatics & Nutrition Research Group (URV)

Official twitter account of the research group in Cheminformatics & Nutrition from the Rovira i Virgili University (@universitaturv)

[Santi Garcia-Vallve @sgvallve]

Excellent article just published, based on the final degree thesis of @pgarciasegura: SARS-CoV-2 main protease (M-pro) mutational profiling: An insight into mutation coldspots. Computers in Biology and Medicine, vol. 184, Jan. 2025, 109344.

[Cheminformatics & Nutrition Research Group (URV) @cheminform_URV]

Our latest article "SARS-CoV-2 main protease (M-pro) mutational profiling: An insight into mutation coldspots" has just been published in Computers in Biology and Medicine. Congratulations to @pgarciasegura and @jmestrestruyol for their hard work.

https://t.co/3hEENZ06Gn

[Cheminformatics & Nutrition Research Group (URV) @cheminform_URV]

Our latest article has just been published in Drug Discovery Today. If you use protein-ligand docking during your VS, our work will help you get the most out of your calculations. Congratulations to @ariadnallop_ and Guillem Macip for their hard work.

https://t.co/2ZdDvMJBeA

[Cheminformatics & Nutrition Research Group (URV) @cheminform_URV]

Congratulations Bryan !!! You did a great job !!!

[Bryan Saldivar @bsaldivaremc2]

Finally I defended my PhD thesis. Thanks to the support and guidance of my supervisors @Gerard_Pujadas @sgvallve Adrià Cereto. And all my gratitude towards my friends @acomajuncosa @00dylan_dalt00 @elenapareja10 @jorba_guillem Aleix Gimeno, Gema Rojas for being there for me.

[Cheminformatics & Nutrition Research Group (URV) @cheminform_URV]

Yesterday, our PhD student @bsaldivaremc2 defended his doctoral thesis titled "Application of machine learning methods on SARS-Cov-2: Mortality prediction by using health and nutritional factors and prediction of recurrent mutations".

Congratulations, Dr Saldivar !!!

[Cheminformatics & Nutrition Research Group (URV) @cheminform_URV]

@pgarciasegura @CampusClinicUB @UBneuroscience Moltes felicitats Pol !!! Realment ets polifacètic !!!

[Cheminformatics & Nutrition Research Group (URV) @cheminform_URV]

Our article "Haste makes waste: A critical review of docking-based virtual screening in drug repurposing for SARS-CoV-2 main protease (M-pro) inhibition" doi:10.1002/med.21862 received enough citations to be a #TopCitedArticle in the journal Medicinal Research Reviews (IF 13.3)

[Cheminformatics & Nutrition Research Group (URV) @cheminform_URV]

Molt orgullosos que la nostra doctoranda @ariadnallop_ hagi rebut el Premi del Públic en l'onzena edició del concurs “Vols saber què investigo?” de monòlegs científics

Moltes felicitats Ariadna !!!

[Cheminformatics & Nutrition Research Group (URV) @cheminform_URV]

A new article from the @cheminform_URV research group at @universitatURV has been published at @BriefingBioinfo:

[Santi Garcia-Vallve @sgvallve]

A. Llop-Peiró, G. Pujadas, S. Garcia-Vallvé. Challenges in distinguishing functional proteins from polyproteins in databases: implications for drug discovery. Briefings in Bioinformatics, Volume 25, Issue 2, March 2024, bbae012. https://t.co/MviZfeE1qg

[Santi Garcia-Vallve @sgvallve]

A. Llop-Peiró, G. Pujadas, S. Garcia-Vallvé. Challenges in distinguishing functional proteins from polyproteins in databases: implications for drug discovery. Briefings in Bioinformatics, Volume 25, Issue 2, March 2024, bbae012. https://t.co/MviZfeE1qg

[Cheminformatics & Nutrition Research Group (URV) @cheminform_URV]

Our manuscript in collaboration with the research group of Prof. Armando Rossello (@Unipisa) is already published. We are happy to work with our Italian colleagues to find new drugs against osteoarthritis https://t.co/HyyuLKHD8I

[Cheminformatics & Nutrition Research Group (URV) @cheminform_URV]

@comunicacioURV @sgvallve @bioquimicaURV @deimurv @ondacerotgn @quimicaURV @enologiaURV

[Gerard Pujadas @GerardPujadas]

Des de @cheminform_URV i ASCLEPIUS estem aprofitant tot el que hem après amb la COVID-19 per preparar-nos per ser més eficients en la cerca de fàrmacs contra noves pandèmies. Si vols saber com ho fem, escolta l'entrevista de @PabloAlcarazG #NEXT_PANDEMICS https://t.co/5BGsuomsqo

[Cheminformatics & Nutrition Research Group (URV) @cheminform_URV]

Muy contentos que @cientificospe haga una reseña del estudio realizado por @bsaldivaremc2 en nuestro grupo de investigación @comunicacioURV @cofundURV

[Cientificos.pe @cientificospe]

Buenos días comunidad! El #Paperperuano de esta semana trata sobre Redes Neuronales Artificiales (RNA) y sus aplicaciones. Llega gracias a la colaboracion de Bryan Saldivar @bsaldivaremc2, estudiante de doctorado en la Universidad Rovira I Virgili en Cataluña Abrimos hilo (1/7)

[Cheminformatics & Nutrition Research Group (URV) @cheminform_URV]

The SARS-CoV-2 mutational portal is out. It contains SARS-CoV-2 mutation data derived from the analysis of more than 4.5 million complete genomes available in GISAID. More info at https://t.co/YzsapXKzEW

[Cheminformatics & Nutrition Research Group (URV) @cheminform_URV]

@pgarciasegura @ppuigbo @bsaldivaremc2 @Gerard_Pujadas @GerardPujadas @nilnovau @bioquimicaURV @comunicacioURV @quimicaURV @enologiaURV

[Santi Garcia-Vallve @sgvallve]

We have published a new article about "The Mutational Landscape of SARS-CoV-2" https://t.co/KaFmq1jMGt #mdpiijms via @IJMS_MDPI

[Cheminformatics & Nutrition Research Group (URV) @cheminform_URV]

Our first paper in collaboration with the ASCLEPIUS research group at URV is now available and opens the door to coupling quantitative prediction of bioactivity in virtual screening to find new non-covalent M-pro inhibitors of SARS-CoV-2. https://t.co/W494q23Zuf

[Cheminformatics & Nutrition Research Group (URV) @cheminform_URV]

New doctoral dissertation in our research group next Monday May 15: : "Studying the limits of protein-ligand docking to predict new non-covalent inhibitors for the SARS-CoV-2 main protease" by Guillem Macip Sancho.