pwm-agent-drug
The PWM Drug-design agent — computational drug design and medicinal chemistry:
molecular docking, ADMET prediction, similarity search, and lead optimization,
grounded in the PWM registry of principles, digital twins, benchmarks, and
solutions. It runs on the shared pwm-agent-core runtime.
Install:
pip install pwm-agent-drug
Log in and run standalone:
pwm-drug login
pwm-drug
It also embeds into AI4Science
automatically once installed — AI4Science discovers it via the
pwm_agent.specs entry point, so drug-design shows up as a selectable
agent alongside the built-in modes with no extra configuration.
1 maintainer
Metadata
1 maintainer
Release files for pwm-agent-drug 0.1.0
For a detailed explanation of source distributions (sdists) and built distributions (wheels), please see the package formats documentation.
Source distribution (sdist)
| File | Size | Uploaded | |
|---|---|---|---|
| pwm_agent_drug-0.1.0.tar.gz | 4.0 kB | Details |
Built distribution (wheel)
| File | Interpreter | ABI | Platform | Reset |
|---|---|---|---|---|
| pwm_agent_drug-0.1.0-py3-none-any.whl | Python 3 | none | any | Details |
Total release size: 8.6 kB
Release files / pwm_agent_drug-0.1.0.tar.gz
| Download URL | pwm_agent_drug-0.1.0.tar.gz |
|---|---|
| Size | 4.0 kB |
| Tags | Source |
|
SHA-256 checksum How to use checksums |
855777f80c6d927ffb3612f395b336608fd221c247040182e03e0d93f5ed3dd4
|
|
BLAKE2b-256 checksum How to use checksums |
e3349f9d3cc02ed937625897a1c26053f38cc70ca442b84e9b998d83d1ecdd6c
|
| Upload date | |
|
Uploaded using Trusted Publishing? What is trusted publishing? |
No |
| Uploaded via |
twine/6.2.0 CPython/3.12.3
|
Release files / pwm_agent_drug-0.1.0-py3-none-any.whl
| Download URL | pwm_agent_drug-0.1.0-py3-none-any.whl |
|---|---|
| Size | 4.7 kB |
| Tags | Python 3 |
|
SHA-256 checksum How to use checksums |
a08e956f289be14563fb4e3c49738fb7dab2c86126226d482373d4f04c5e8860
|
|
BLAKE2b-256 checksum How to use checksums |
25d6c835742492df6c54022aba5d510a7b08eb72ee48b71a71fa0a07e2ed1c8b
|
| Upload date | |
|
Uploaded using Trusted Publishing? What is trusted publishing? |
No |
| Uploaded via |
twine/6.2.0 CPython/3.12.3
|
