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Mehtap Işık

4PUBLICATIONS
11CO-AUTHORS
Cheminformatics and quantitative structure-activity relationshipsComputational chemistryBiomolecular modelling and design
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Journal

Publications (4)

Sort by Publication Date:
|Apr 15, 2022
SAMPL7 protein-ligand challenge: A community-wide evaluation of computational methods against fragment screening and pose-prediction.

Harold Grosjean, Mehtap Işık, Anthony Aimon

|Jan 04, 2021
Overview of the SAMPL6 pK<sub>a</sub> challenge: evaluating small molecule microscopic and macroscopic pK<sub>a</sub> predictions.

Mehtap Işık, Ariën S Rustenburg, Andrea Rizzi

|Feb 29, 2020
Assessing the accuracy of octanol-water partition coefficient predictions in the SAMPL6 Part II log P Challenge.

Mehtap Işık, Teresa Danielle Bergazin, Thomas Fox

|Dec 21, 2019
Octanol-water partition coefficient measurements for the SAMPL6 blind prediction challenge.

Mehtap Işık, Dorothy Levorse, David L Mobley

Pageof 1

Frequent Collaborators

4 joint publications

David Mobley

4 joint publications

John D Chodera

2 joint publications

Andrea Rizzi

1 joint publications

Timothy Rhodes

1 joint publications

Teresa Danielle Bergazin

1 joint publications

Thomas Fox

1 joint publications

Ariën S Rustenburg

1 joint publications

M R Gunner

1 joint publications

Anthony Aimon

1 joint publications

Frank von Delft

Frequent Collaborators

4 joint publications

David Mobley

4 joint publications

John D Chodera

2 joint publications

Andrea Rizzi

1 joint publications

Timothy Rhodes

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