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Uploaded Tue Aug 21 15:13:20 2018
md5 checksum 0a65ff0e447bb78fcc6105db981c308c
arch x86_64
build py35_0
depends acecloud-client >=1.0.42, acemd >=2017.11.30, ambermini >=16.16.0, anaconda-client >=1.7.1, dftd3 >=3.2.0, htmd-data 0.1.hash7ce33d0, htmd-pdb2pqr >=2.1.1+htmd.3, ipyparallel >=6.2.2, ipython >=6.5.0, ipywidgets 7.0.0, joblib >=0.12.2, jupyter_console >=5.2.0, match >=0.0.6, matplotlib >=2.2.2, mdtraj >=1.9.1, natsort >=5.3.3, networkx >=2.1, nglview >=1.0, nlopt >=2.4.2, notebook >=5.6.0, numba >=0.38.1, openbabel >=2.4.1, openmm >=7.1.1, openpyxl >=2.5.5, pandas >=0.23.4, parmed >=2.7.3, pcmsolver >=1.2.1, periodictable >=1.5.0, pint >=0.7.2, plumed2 >=2.3.3+htmd.4, propka >=3.1.8, protocolinterface >=0.1.9, psfgen >=1.6.9, psi4 1.2.1.*, pyemma >=2.4, pyparsing >=2.2.0, python >=3.5,<3.6.0a0, rdkit >=2017.09.2.0, requests >=2.19.1, scikit-learn >=0.19.1, tqdm >=4.25.0, vina >=1.1.101, widgetsnbextension 3.0.0
machine x86_64
operatingsystem linux
platform linux
subdir linux-64
target-triplet x86_64-any-linux
timestamp 1534862513698