Antoine Daina

Lausanne, VD 1015, Switzerland

Last Updated: 09/26/2026

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Found 22 publications

SwissDock 2024: major enhancements for small-molecule docking with Attracting Cavities and AutoDock Vina.

SwissDock 2024: major enhancements for small-molecule docking with Attracting Cavities and AutoDock Vina.

Journal: Nucleic acids research

Published: January 31, 2024

SwissParam 2023: A Modern Web-Based Tool for Efficient Small Molecule Parametrization.

SwissParam 2023: A Modern Web-Based Tool for Efficient Small Molecule Parametrization.

Journal: Journal of chemical information and modeling

Published: October 19, 2023

Testing the predictive power of reverse screening to infer drug targets, with the help of machine learning.

Testing the predictive power of reverse screening to infer drug targets, with the help of machine learning.

Journal: Communications chemistry

Published: April 06, 2023

Secondary IDH1 resistance mutations and oncogenic IDH2 mutations cause acquired resistance to ivosidenib in cholangiocarcinoma.

Secondary IDH1 resistance mutations and oncogenic IDH2 mutations cause acquired resistance to ivosidenib in cholangiocarcinoma.

Journal: NPJ precision oncology

Published: December 20, 2021

The SwissSimilarity 2021 Web Tool: Novel Chemical Libraries and Additional Methods for an Enhanced Ligand-Based Virtual Screening Experience.

The SwissSimilarity 2021 Web Tool: Novel Chemical Libraries and Additional Methods for an Enhanced Ligand-Based Virtual Screening Experience.

Journal: International journal of molecular sciences

Published: December 20, 2021

FGFR2 Extracellular Domain In-Frame Deletions Are Therapeutically Targetable Genomic Alterations That Function as Oncogenic Drivers in Cholangiocarcinoma.

FGFR2 Extracellular Domain In-Frame Deletions Are Therapeutically Targetable Genomic Alterations That Function as Oncogenic Drivers in Cholangiocarcinoma.

Journal: Cancer discovery

Published: November 20, 2020

The impact of structural bioinformatics tools and resources on SARS-CoV-2 research and therapeutic strategies.

The impact of structural bioinformatics tools and resources on SARS-CoV-2 research and therapeutic strategies.

Journal: Briefings in bioinformatics

Published: September 10, 2020

Application of the SwissDrugDesign Online Resources in Virtual Screening.

Application of the SwissDrugDesign Online Resources in Virtual Screening.

Journal: International journal of molecular sciences

Published: August 15, 2019

SwissTargetPrediction: updated data and new features for efficient prediction of protein targets of small molecules.

SwissTargetPrediction: updated data and new features for efficient prediction of protein targets of small molecules.

Journal: Nucleic acids research

Published: February 11, 2019

Rational Design, Synthesis, and Pharmacological Characterization of Novel Ghrelin Receptor Inverse Agonists as Potential Treatment against Obesity-Related Metabolic Diseases.

Rational Design, Synthesis, and Pharmacological Characterization of Novel Ghrelin Receptor Inverse Agonists as Potential Treatment against Obesity-Related Metabolic Diseases.

Journal: Journal of medicinal chemistry

Published: September 29, 2018

Educational Tools to Introduce Computer-Aided Drug Design to Students and to the Public at Large.

Educational Tools to Introduce Computer-Aided Drug Design to Students and to the Public at Large.

Journal: Chimia

Published: March 02, 2018

SwissADME: a free web tool to evaluate pharmacokinetics, drug-likeness and medicinal chemistry friendliness of small molecules.

SwissADME: a free web tool to evaluate pharmacokinetics, drug-likeness and medicinal chemistry friendliness of small molecules.

Journal: Scientific reports

Published: October 05, 2016

Showing 1-12 of 22

Last Updated: 09/26/2026