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Theoretical and Computational Chemistry

Working Paper

Wrapping up Viruses at Multiscale Resolution: Optimizing PACKMOL and SIRAH Execution for Simulating the Zika Virus.

Martín Soñora, Leandro Martinez, Sergio Pantano, Matías R. Machado

Version 2 posted 17 December 2020

837

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Biological and Medicinal Chemistry

Working Paper

Statistical Force-Field for Structural Modeling Using Chemical Cross-Linking/mass Spectrometry Distance Constraints

Allan J. R. Ferrari, Fabio C. Gozzo, Leandro Martinez

Version 1 posted 27 March 2018

599

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Chemical Education

Working Paper

Measuring the conductivity of very dilute electrolyte solutions, drop by drop

Leandro Martinez

Version 2 posted 20 November 2017

2,421

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Organic Chemistry

Working Paper

NaturAr, a collaborative, open source, database of natural products from Argentinian biodiversity for drug discovery and bioprospecting

Leandro Martínez-Heredia, Patricia Quispe, Julián Fernández, Martin Lavecchia

Version 1 posted 15 July 2024

190

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Chemical Engineering and Industrial Chemistry

Working Paper

Fractionation of Squid Pens with Ionic Liquids – An upgraded β-Chitin and Shellfish Protein Production

Pedro Nakasu, Vinícius Piccoli, Antonio Ovejero-Pérez, Priyanka Kumar, Amir Al-Ghatta, Susiana Melanie, Cariny Polesca, Leandro Martínez, Jason Hallett

Version 1 posted 12 December 2024

55

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Theoretical and Computational Chemistry

Working Paper

Moltiverse: Molecular Conformer Generation Using Enhanced Sampling Methods

Mauricio Bedoya, Francisco Adasme-Carreño, Paula Andrea Peña-Martínez, Camila Muñoz-Gutiérrez, Luciano Peña-Tejo, José C.E. Márquez Montesinos, Erix W. Hernández-Rodríguez, Wendy González, Leandro Martínez, Jans Alzate-Morales

Version 2 posted 18 December 2024

346

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Theoretical and Computational Chemistry

Working Paper

Drug interaction profiles classification: Sørensen–Dice coefficient based on MM/GBSA energies to explore focal adhesion kinase inhibitors

Patricia Quispe, Leandro Martínez Heredia, Ignacio León, Martin Lavecchia

Version 1 posted 30 August 2024

77

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Refine Search

7 results in Leandro Martínez in Authors: Leandro Martínez

Wrapping up Viruses at Multiscale Resolution: Optimizing PACKMOL and SIRAH Execution for Simulating the Zika Virus.

Statistical Force-Field for Structural Modeling Using Chemical Cross-Linking/mass Spectrometry Distance Constraints

Measuring the conductivity of very dilute electrolyte solutions, drop by drop

NaturAr, a collaborative, open source, database of natural products from Argentinian biodiversity for drug discovery and bioprospecting

Fractionation of Squid Pens with Ionic Liquids – An upgraded β-Chitin and Shellfish Protein Production

Moltiverse: Molecular Conformer Generation Using Enhanced Sampling Methods

Drug interaction profiles classification: Sørensen–Dice coefficient based on MM/GBSA energies to explore focal adhesion kinase inhibitors

7 results in Authors: Leandro Martínez