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Kay Schaller

Orcid: 0000-0003-1555-5626

According to our database1, Kay Schaller authored at least 3 papers between 2018 and 2023.

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

Timeline

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Links

On csauthors.net:

Bibliography

2023
Correction to "Machine Learning of Partial Charges Derived From High-Quality Quantum-Mechanical Calculations".
[BibTeX]
[DOI]
Patrick Bleiziffer
,
Kay Schaller
,
Sereina Riniker
J. Chem. Inf. Model., April, 2023

2022
Replica-Exchange Enveloping Distribution Sampling Using Generalized AMBER Force-Field Topologies: Application to Relative Hydration Free-Energy Calculations for Large Sets of Molecules.
[BibTeX]
[DOI]
Salomé Rieder
,
Benjamin Ries
,
Kay Schaller
,
Candide Champion
,
Emília P. Barros
,
Philippe H. Hünenberger
,
Sereina Riniker
J. Chem. Inf. Model., 2022

2018
Machine Learning of Partial Charges Derived from High-Quality Quantum-Mechanical Calculations.
[BibTeX]
[DOI]
Patrick Bleiziffer
,
Kay Schaller
,
Sereina Riniker
J. Chem. Inf. Model., 2018


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