GSoC2025_Hbond_PM
importedtherapeutics/gsoc2025-hbond-pm
GSoC 2025 - MDAnalysis x ProLIF Project 5: H-Bond interactions from implicit hydrogens
Machine-generated from the listed sources and not yet reviewed by a human.
- Category
- Therapeutics
- Subcategory
- unknown
- License
- Apache-2.0(osi)
- Status
- maintained
- Maturity
- deployed
- Organization
- unknown
- Country
- unknown
- Documentation
- unknown
- Tags
- cheminformatics · fingerprint · hydrogen-bond · implicit-hydrogen · interaction · molecular-dynamics · smiles-strings · structural-biology
- Regulatory
- unknown
Computed from shared tags, weighted so a rare tag counts for more than a common one. These are suggestions, not curated relationships.
- kaggle_leash_belkafingerprint · smiles-strings
11th place solution of NeurIPS 2024 - Predict New Medicines with BELKA competition on Kaggle: https://www.kaggle.com/competitions/leash-BELKA
- drug-discovery-agent-skillscheminformatics · molecular-dynamics · structural-biology
Agent Skills for small-molecule and protein therapeutics: cheminformatics, molecular ML, docking and dynamics, protein design platforms, and target-discovery knowledge graphs.
- e3fpcheminformatics · fingerprint
3D molecular fingerprints
- e3fp-papercheminformatics · fingerprint
3D molecular fingerprints (E3FP) paper repo
- logD_predictorcheminformatics · fingerprint
Prediction of CHI logD from ¹H/¹³C NMR spectra and molecular fingerprints using ML and deep learning.
- Rcpicheminformatics · fingerprint
💊 Molecular informatics toolkit with integration of bioinformatics and cheminformatics tools for drug discovery
- api.github.com/repos/yuyuan871111/GSoC2025_Hbond_PMretrieved 2026-08-25 · via github-api
Machine-imported from GitHub search. Last push 2025-09-01, 4 stars, license reported as Apache-2.0. Category and schematic were assigned by keyword heuristics and are unreviewed.
Not yet verified by a human. Correct this record →
/v1/entries/62.json→ .entries["gsoc2025-hbond-pm"]
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