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.
Download files
Download the file for your platform. If you're not sure which to choose, learn more about installing packages.
Source Distribution
frag_pele-3.1.4.tar.gz
(163.3 kB
view details)
Built Distribution
Filter files by name, interpreter, ABI, and platform.
If you're not sure about the file name format, learn more about wheel file names.
Copy a direct link to the current filters
frag_pele-3.1.4-py3-none-any.whl
(185.6 kB
view details)
File details
Details for the file frag_pele-3.1.4.tar.gz.
File metadata
- Download URL: frag_pele-3.1.4.tar.gz
- Upload date:
- Size: 163.3 kB
- Tags: Source
- Uploaded using Trusted Publishing? No
- Uploaded via:
twine/4.0.1 CPython/3.10.5
File hashes
| Algorithm | Hash digest | |
|---|---|---|
| SHA256 |
9b052c10d41a0b8299e415ffa6ebbee7b60712c83954b994e40b92d3ae716a1d
|
|
| MD5 |
73fe86e789121bb67b43dfa8dd495851
|
|
| BLAKE2b-256 |
690636bcd297a916d4a0e2c35834e20e6a73415648428cb1417548e93fc7c846
|
File details
Details for the file frag_pele-3.1.4-py3-none-any.whl.
File metadata
- Download URL: frag_pele-3.1.4-py3-none-any.whl
- Upload date:
- Size: 185.6 kB
- Tags: Python 3
- Uploaded using Trusted Publishing? No
- Uploaded via:
twine/4.0.1 CPython/3.10.5
File hashes
| Algorithm | Hash digest | |
|---|---|---|
| SHA256 |
feeb68eeb82aa05e7d61e4102c950ec8caa23b24093e59bff79aa0dd212cc3ec
|
|
| MD5 |
3c9bfdf0448eef691a17affa7e7fa591
|
|
| BLAKE2b-256 |
9996e7c37c95b7b4ff38ace877bf34e7be992506223211463c3b3f4776286dfe
|