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EnsembleSurrogateAutoShim-Kinases
EnsembleSurrogateAutoShim-Kinases PublicThis is the open source version of Ensemble Surrogate AutoShim (ESA) applied to protein kinases and first developed at the Novartis Institutes for Biomedical Research, Inc. in Emeryville, Californi…
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SAMUDIO_BENJAMIN_M
SAMUDIO_BENJAMIN_M PublicThis is the Hope Shared Foundation GitHub repository for Benjamin M. Samudio
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ReLiEF-fingerprints
ReLiEF-fingerprints PublicReceptor Ligand surfacE Feature (ReLiEF) fingerprints for the encoding of molecular surfaces, interfaces, and cavities
Python
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- Banigallapati_Sriram Public
- ReLiEF-fingerprints Public
Receptor Ligand surfacE Feature (ReLiEF) fingerprints for the encoding of molecular surfaces, interfaces, and cavities
- TestBinder Public
- SAMUDIO_BENJAMIN_M Public
This is the Hope Shared Foundation GitHub repository for Benjamin M. Samudio
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- EnsembleSurrogateAutoShim-Kinases Public
This is the open source version of Ensemble Surrogate AutoShim (ESA) applied to protein kinases and first developed at the Novartis Institutes for Biomedical Research, Inc. in Emeryville, California by Eric Martin and David Sullivan (DOI: 10.1021/ci700455u). This open source software is maintained and developed by The Hope Shared Foundation (The…
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