Andreas Koch

2PUBLICATIONS
5CO-AUTHORS
Computer aided designBiomolecular modelling and design
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Publications (2)

|Nov 07, 2019
D3R Grand Challenge 4: prospective pose prediction of BACE1 ligands with AutoDock-GPU.

Diogo Santos-Martins, Jerome Eberhardt, Giulia Bianco

|Nov 07, 2019
Comparison of affinity ranking using AutoDock-GPU and MM-GBSA scores for BACE-1 inhibitors in the D3R Grand Challenge 4.

Léa El Khoury, Diogo Santos-Martins, Sukanya Sasmal

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Frequent Collaborators

2 joint publications

Diogo Santos-Martins

2 joint publications

Stefano Forli

1 joint publications

Léa El Khoury

1 joint publications

Sukanya Sasmal