Modenutti C - Search Results

1

LigQ: A Webserver to Select and Prepare Ligands for Virtual Screening.

Radusky L, Ruiz-Carmona S, Modenutti C, Barril X, Turjanski AG, Martí MA. Radusky L, et al. Among authors: modenutti c. J Chem Inf Model. 2017 Aug 28;57(8):1741-1746. doi: 10.1021/acs.jcim.7b00241. Epub 2017 Jul 27. J Chem Inf Model. 2017. PMID: 28700230

2

Solvent structure improves docking prediction in lectin-carbohydrate complexes.

Gauto DF, Petruk AA, Modenutti CP, Blanco JI, Di Lella S, Martí MA. Gauto DF, et al. Glycobiology. 2013 Feb;23(2):241-58. doi: 10.1093/glycob/cws147. Epub 2012 Oct 22. Glycobiology. 2013. PMID: 23089616

3

Using crystallographic water properties for the analysis and prediction of lectin-carbohydrate complex structures.

Modenutti C, Gauto D, Radusky L, Blanco J, Turjanski A, Hajos S, Marti M. Modenutti C, et al. Glycobiology. 2015 Feb;25(2):181-96. doi: 10.1093/glycob/cwu102. Epub 2014 Sep 28. Glycobiology. 2015. PMID: 25267604

4

WATCLUST: a tool for improving the design of drugs based on protein-water interactions.

López ED, Arcon JP, Gauto DF, Petruk AA, Modenutti CP, Dumas VG, Marti MA, Turjanski AG. López ED, et al. Bioinformatics. 2015 Nov 15;31(22):3697-9. doi: 10.1093/bioinformatics/btv411. Epub 2015 Jul 20. Bioinformatics. 2015. PMID: 26198103

5

Molecular Dynamics in Mixed Solvents Reveals Protein-Ligand Interactions, Improves Docking, and Allows Accurate Binding Free Energy Predictions.

Arcon JP, Defelipe LA, Modenutti CP, López ED, Alvarez-Garcia D, Barril X, Turjanski AG, Martí MA. Arcon JP, et al. J Chem Inf Model. 2017 Apr 24;57(4):846-863. doi: 10.1021/acs.jcim.6b00678. Epub 2017 Mar 31. J Chem Inf Model. 2017. PMID: 28318252

6

First Whole-Genome Shotgun Sequence of a Promising Cellulase Secretor, Trichoderma koningiopsis Strain POS7.

Castrillo ML, Bich GÁ, Modenutti C, Turjanski A, Zapata PD, Villalba LL. Castrillo ML, et al. Among authors: modenutti c. Genome Announc. 2017 Sep 14;5(37):e00823-17. doi: 10.1128/genomeA.00823-17. Genome Announc. 2017. PMID: 28912309 Free PMC article.

7

Correction to Molecular Dynamics in Mixed Solvents Reveals Protein-Ligand Interactions, Improves Docking and Allows Accurate Binding Free Energy Predictions.

Arcon JP, Defelipe LA, Modenutti CP, López ED, Alvarez Garcia D, Barril X, Turjanski AG, Martí MA. Arcon JP, et al. J Chem Inf Model. 2018 Jun 25;58(6):1312. doi: 10.1021/acs.jcim.8b00299. Epub 2018 Jun 13. J Chem Inf Model. 2018. PMID: 29897744 No abstract available.

8

An efficient use of X-ray information, homology modeling, molecular dynamics and knowledge-based docking techniques to predict protein-monosaccharide complexes.

Blanco Capurro JI, Di Paola M, Gamarra MD, Martí MA, Modenutti CP. Blanco Capurro JI, et al. Glycobiology. 2019 Feb 1;29(2):124-136. doi: 10.1093/glycob/cwy102. Glycobiology. 2019. PMID: 30407518

9

A Carboxy-Terminal Monoleucine-Based Motif Participates in the Basolateral Targeting of the Na+/I- Symporter.

Martín M, Modenutti CP, Peyret V, Geysels RC, Darrouzet E, Pourcher T, Masini-Repiso AM, Martí MA, Carrasco N, Nicola JP. Martín M, et al. Endocrinology. 2019 Jan 1;160(1):156-168. doi: 10.1210/en.2018-00603. Endocrinology. 2019. PMID: 30496374 Free PMC article.

10

Solvents to Fragments to Drugs: MD Applications in Drug Design.

Defelipe LA, Arcon JP, Modenutti CP, Marti MA, Turjanski AG, Barril X. Defelipe LA, et al. Molecules. 2018 Dec 11;23(12):3269. doi: 10.3390/molecules23123269. Molecules. 2018. PMID: 30544890 Free PMC article. Review.

Save citations to file

Email citations

Send citations to clipboard

Add to Collections

Add to My Bibliography

Create a file for external citation management software

Your saved search

Your RSS Feed

My Custom Filters

Publication date

Text availability

Article attribute

Article type

Article Language

Species

Sex

Age

Other

31 results

Search Page

Filters