FrAG-PELE:
A novel fragment-based growing tool for hit-to-lead in drug design
Installation
Getting Started:
Cite
Perez Lopez, C.; Soler, D.; Soliva, R.; Guallar, V. FragPELE: Dynamic Ligand Growing within a Binding Site. A Novel Tool for Hit-to-Lead Drug Design. J. Chem. Inf. Model. 2020. https://doi.org/10.1021/acs.jcim.9b00938.
1 maintainer
Metadata
1 maintainer
Release files for frag-pele 3.1.4
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Source distribution (sdist)
| File | Size | Uploaded | Provenance | Actions |
|---|---|---|---|---|
| frag_pele-3.1.4.tar.gz | 163.3 kB | Without provenance | Details for frag_pele-3.1.4.tar.gz |
Built distribution (wheel)
| File | Interpreter | ABI | Platform | Actions Reset |
|---|---|---|---|---|
| frag_pele-3.1.4-py3-none-any.whl | Python 3 | none | any | Details for frag_pele-3.1.4-py3-none-any.whl |
Total release size: 348.8 kB
Release files / frag_pele-3.1.4.tar.gz
| Download URL | frag_pele-3.1.4.tar.gz |
|---|---|
| Size | 163.3 kB |
| Tags | Source |
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SHA-256 checksum How to use checksums |
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BLAKE2b-256 checksum How to use checksums |
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| Upload date | |
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Uploaded using Trusted Publishing? What is trusted publishing? |
No |
| Uploaded via |
twine/4.0.1 CPython/3.10.5
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Release files / frag_pele-3.1.4-py3-none-any.whl
| Download URL | frag_pele-3.1.4-py3-none-any.whl |
|---|---|
| Size | 185.6 kB |
| Tags | Python 3 |
|
SHA-256 checksum How to use checksums |
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BLAKE2b-256 checksum How to use checksums |
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| Upload date | |
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Uploaded using Trusted Publishing? What is trusted publishing? |
No |
| Uploaded via |
twine/4.0.1 CPython/3.10.5
|
Security for frag-pele 3.1.4
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