Viktorya Aviyente

Orcid: 0000-0001-9430-4096

According to our database1, Viktorya Aviyente authored at least 11 papers between 2000 and 2023.

Collaborative distances:
  • Dijkstra number2 of five.
  • Erdős number3 of five.

Timeline

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Bibliography

2023
Quantum Mechanical Prediction of Dissociation Constants for Thiazol-2-imine Derivatives.
J. Chem. Inf. Model., May, 2023

2021
Using Atomic Charges to Describe the pKa of Carboxylic Acids.
J. Chem. Inf. Model., 2021

SAMPL7 blind challenge: quantum-mechanical prediction of partition coefficients and acid dissociation constants for small drug-like molecules.
J. Comput. Aided Mol. Des., 2021

2020
A blind SAMPL6 challenge: insight into the octanol-water partition coefficients of drug-like molecules via a DFT approach.
J. Comput. Aided Mol. Des., 2020

2017
Assessing protein-ligand binding modes with computational tools: the case of PDE4B.
J. Comput. Aided Mol. Des., 2017

2004
Solvent effects on glycine II. Water-assisted tautomerization.
J. Comput. Chem., 2004

Solvent effects on glycine. I. A supermolecule modeling of tautomerization via intramolecular proton transfer - Erratum.
J. Comput. Chem., 2004

Solvent effect on the synthesis of clarithromycin: A molecular dynamics study.
J. Comput. Aided Mol. Des., 2004

Theoretical study of selective methylation in the synthesis of azithromycin.
J. Comput. Aided Mol. Des., 2004

2003
Solvent effects on glycine. I. A supermolecule modeling of tautomerization via intramolecular proton transfer.
J. Comput. Chem., 2003

2000
Conformational properties of amphotericin B amide derivatives - impact on selective toxicity.
J. Comput. Aided Mol. Des., 2000


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