biosimspace
importedtherapeutics/biosimspace
An interoperable Python framework for biomolecular simulation.
Machine-generated from the listed sources and not yet reviewed by a human.
- Category
- Therapeutics
- Subcategory
- unknown
- License
- GPL-3.0(osi)
- Status
- active
- Maturity
- deployed
- Organization
- OpenBioSim
- Country
- unknown
- Homepage
- biosimspace.openbiosim.org
- Repository
- github.com/OpenBioSim/biosimspace
- Documentation
- unknown
- Tags
- biomolecular-simulation · computational-biology · computational-chemistry · computational-physics · drug-discovery · free-energy-calculations · interoperability · molecular-dynamics
- Regulatory
- unknown
Top contributors by commit count, from the project’s public repository. Avatars are served by their origin, not stored here. To be removed from this list, open an issue.
Computed from shared tags, weighted so a rare tag counts for more than a common one. These are suggestions, not curated relationships.
- equiformer_v2computational-chemistry · computational-physics · drug-discovery
[ICLR 2024] EquiformerV2: Improved Equivariant Transformer for Scaling to Higher-Degree Representations
- polypharmcomputational-chemistry · free-energy-calculations
A Python-based library to perform IFD and MM/GBSA calculations on different targets using a polypharmacological approach.
- litmattercomputational-chemistry · drug-discovery · molecular-dynamics
Rapid experimentation and scaling of deep learning models on molecular and crystal graphs.
- icsg3dcomputational-chemistry · computational-physics
3-D Inorganic Crystal Structure Generation and Property Prediction via Representation Learning (JCIM 2020)
- asapdiscoverycomputational-biology · computational-chemistry · drug-discovery
Toolkit for open antiviral drug discovery by the ASAP Discovery Consortium
- dock6computational-biology · computational-chemistry · drug-discovery
DOCK6 is a molecular docking program.
- api.github.com/repos/OpenBioSim/biosimspaceretrieved 2026-08-05 · via github-api
Machine-imported from GitHub search. Last push 2026-08-05, 168 stars, license reported as GPL-3.0. Category and schematic were assigned by keyword heuristics and are unreviewed.
Not yet verified by a human. Correct this record →
/v1/entries/38.json→ .entries["biosimspace"]
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