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Uploaded Mon Sep 6 11:51:15 2021
md5 checksum 43ab8c1baed16b313aabdfd5d7f44a2b
arch x86_64
build py36_0
depends acemd3 >=3.3.0, ambertools >=20.15, anaconda-client >=1.7.2, ffevaluation >=0.1.5, htmd-pdb2pqr >=2.1.1+htmd.14, ipython >=5.8.0, joblib >=1.0.1, jobqueues >=0.6.5, jupyter_console >=5.2.0, matplotlib >=3.3.4, mdtraj >=1.9.3, moleculekit >=0.5.8, natsort >=7.1.1, networkx >=2.6.2, nglview >=2.7.0, notebook >=6.3.0, numba >=0.53.1, numpy >=1.17, openbabel >=3.1.1, openmm >=7.4.1, openpyxl >=3.0.7, pandas >=1.1.2, pint >=0.7.2, plumed2 >=2.3.3+htmd.4, propka 3.1.8.*, protocolinterface >=0.3.0, psfgen >=1.6.9, pyemma >=2.5.9, python >=3.6,<3.7.0a0, python_abi 3.6.* *_cp36m, rdkit >=2020.09.3, scikit-learn >=0.24.2, tqdm >=4.62.2, vina >=1.1.101
machine x86_64
operatingsystem linux
platform linux
subdir linux-64
target-triplet x86_64-any-linux
timestamp 1630928662560