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Merge pull request #19291 from UnixJunkie/fasmifra_110
added packages/fasmifra/fasmifra.1.1.0/opam
authored by
Marcello Seri
and committed by
GitHub
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packages/fasmifra/fasmifra.1.1.0/opam
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packages/fasmifra/fasmifra.1.1.0/opam
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opam-version: "2.0"
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authors: "Francois Berenger"
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maintainer: "unixjunkie@sdf.org"
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homepage: "https://github.com/UnixJunkie/FASMIFRA"
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bug-reports: "https://github.com/UnixJunkie/FASMIFRA/issues"
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dev-repo: "git+https://github.com/UnixJunkie/FASMIFRA.git"
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license: "GPL-3.0-or-later"
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build: ["dune" "build" "-p" name "-j" jobs]
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install: [
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["cp" "bin/fasmifra_fragment.py" "%{bin}%/fasmifra_fragment.py"]
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]
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depends: [
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"base-unix"
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"batteries" {>= "3.3.0"}
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"dolog" {>= "6.0.0"}
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"dune" {>= "1.11"}
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"minicli" {>= "5.0.0"}
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"ocaml"
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"parany" {>= "12.0.0"}
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"line_oriented" {>= "1.0.0"}
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"conf-rdkit" {>= "1"}
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"conf-python-3" {>= "1.0.0"}
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]
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synopsis: "Molecular Generation by Fast Assembly of SMILES Fragments"
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description: """
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Generate molecules fast given a molecular training set.
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Properties of the generated molecules might significantly match
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those of the training set (training set distribution matching).
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Reference implementation for a submitted manuscript.
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"""
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url {
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src: "https://github.com/UnixJunkie/FASMIFRA/archive/refs/tags/v1.1.0.tar.gz"
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checksum: "md5=d12b87ec8a1a361ef4d9fa1c23615869"
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}