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NostrumBioDiscovery / packages / frag_pele

FragPELE, a new tool for in silico hit-to-lead drug design, capable of growing a fragment into a core while exploring the protein-ligand conformational space.

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Type Size Name Uploaded Downloads Labels
conda 268.5 kB | linux-64/frag_pele-3.1.4-py37hfeaa757_0.tar.bz2  2 years and 8 months ago 9 main
conda 262.8 kB | osx-64/frag_pele-3.1.4-py37h7772d1b_0.tar.bz2  2 years and 8 months ago 3 main
conda 268.2 kB | osx-64/frag_pele-3.1.4-py38h7772d1b_0.tar.bz2  2 years and 8 months ago 8 main
conda 251.6 kB | linux-64/frag_pele-3.1.4-py38hfeaa757_0.tar.bz2  2 years and 8 months ago 54 main
conda 263.6 kB | osx-64/frag_pele-3.1.3-py37h7772d1b_0.tar.bz2  2 years and 8 months ago 2 main
conda 263.5 kB | linux-64/frag_pele-3.1.3-py37hfeaa757_0.tar.bz2  2 years and 8 months ago 2 main
conda 261.5 kB | osx-64/frag_pele-3.1.3-py38h7772d1b_0.tar.bz2  2 years and 8 months ago 2 main
conda 261.8 kB | linux-64/frag_pele-3.1.3-py38hfeaa757_0.tar.bz2  2 years and 8 months ago 2 main
conda 251.9 kB | osx-64/frag_pele-3.1.2-py37h7772d1b_0.tar.bz2  2 years and 8 months ago 2 main
conda 263.4 kB | linux-64/frag_pele-3.1.2-py37hfeaa757_0.tar.bz2  2 years and 8 months ago 2 main
conda 259.7 kB | osx-64/frag_pele-3.1.2-py38h7772d1b_0.tar.bz2  2 years and 8 months ago 2 main
conda 249.1 kB | linux-64/frag_pele-3.1.2-py38hfeaa757_0.tar.bz2  2 years and 8 months ago 3 main
conda 261.8 kB | osx-64/frag_pele-3.1.1-py37h39e3cac_0.tar.bz2  3 years and 8 months ago 10 main
conda 267.0 kB | osx-64/frag_pele-3.1.1-py38h7772d1b_0.tar.bz2  3 years and 8 months ago 15 main
conda 249.2 kB | linux-64/frag_pele-3.1.1-py37hfeaa757_0.tar.bz2  3 years and 8 months ago 40 main
conda 267.8 kB | linux-64/frag_pele-3.1.1-py38hfeaa757_0.tar.bz2  3 years and 8 months ago 205 main
conda 266.9 kB | osx-64/frag_pele-3.0.0-py38h7772d1b_0.tar.bz2  3 years and 10 months ago 6 main
conda 257.4 kB | osx-64/frag_pele-3.0.0-py37h39e3cac_0.tar.bz2  3 years and 10 months ago 5 main
conda 261.0 kB | linux-64/frag_pele-3.0.0-py37hfeaa757_0.tar.bz2  3 years and 10 months ago 5 main
conda 257.8 kB | linux-64/frag_pele-3.0.0-py38hfeaa757_0.tar.bz2  3 years and 10 months ago 11 main
conda 226.2 kB | linux-64/frag_pele-2.2.1-py38h39e3cac_0.tar.bz2  4 years and 8 months ago 2216 main
conda 220.0 kB | linux-64/frag_pele-2.2.1-py37h39e3cac_0.tar.bz2  4 years and 8 months ago 333 main
conda 215.5 kB | linux-64/frag_pele-2.1.3-py37h39e3cac_0.tar.bz2  4 years and 11 months ago 120 main
conda 216.7 kB | linux-64/frag_pele-2.1.3-py36h39e3cac_0.tar.bz2  4 years and 11 months ago 5 main
conda 216.5 kB | linux-64/frag_pele-2.1.3-py38h39e3cac_0.tar.bz2  4 years and 11 months ago 158 main
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