×

No Description

Uploaded Tue Mar 11 22:50:36 2025
md5 checksum 77c55147df7cadae2b52f6ffbd2f496a
arch x86_64
build py310hff52083_2
build_number 2
depends airium, alchemiscale-client, appdirs, ase, biopython, boto3, cinnabar >=0.4.1, click, codecov, cudatoolkit, dask, dask-cuda, dask-jobqueue, dgl, dgllife, distributed, e3nn, flask, flask-cors, gifsicle, gufe <1.3.0, h5py, httpx, imageio, kartograf, logomaker, mdanalysis, mdtraj, mock, moto, mtenn >=0.5.1, multimethod, netifaces, numpy, openfe >1.1.0*, openff-toolkit, openmm, openmmforcefields, pandas, perses >=0.10.2, plip, plotly, pooch, pydantic >=1.10.8,<2.0.0a0, pygifsicle, pymol-open-source, pytest, pytest-console-scripts, pytest-cov, pytest-timeout, pytest-xdist, python >=3.10,<3.11.0a0, python_abi 3.10.* *_cp310, pytorch, pytorch_cluster, pytorch_geometric >=2.5.0, pytorch_scatter, pytorch_sparse, pyyaml, rdkit, requests, requests-mock, rich, semver, sigfig, typing-extensions, validators, wandb
has_prefix True
license MIT
license_family MIT
machine x86_64
operatingsystem linux
platform linux
subdir linux-64
target-triplet x86_64-any-linux
timestamp 1741733100694