Package: atomes Source: atomes (1.3.1-1) Version: 1.3.1-1+b1 Architecture: amd64 Maintainer: Debichem Team Installed-Size: 3867 Depends: atomes-data (= 1.3.1-1), libavcodec63 (>= 7:9.0.2), libavformat63 (>= 7:9.0.2), libavutil61 (>= 7:9.0.2), libc6 (>= 2.43), libcairo2 (>= 1.6.0), libepoxy0 (>= 1.0), libgcc-s1 (>= 4.0), libgdk-pixbuf-2.0-0 (>= 2.22.0), libgfortran5 (>= 10), libglib2.0-0t64 (>= 2.76.0), libgomp1 (>= 4.9), libgtk-3-0t64 (>= 3.21.5), libpango-1.0-0 (>= 1.22.0), libpangocairo-1.0-0 (>= 1.14.0), libpangoft2-1.0-0 (>= 1.14.0), libswscale10 (>= 7:9.0.2), libxml2-16 (>= 2.14.1), libglu1-mesa, bash-completion Section: science Priority: optional Homepage: https://atomes.ipcms.fr/ Description: atomic-scale 3D modeling toolbox atomes is a tool box to analyze (physico-chemical properties calculations), visualize (atoms, bonds, colormaps, measurements, coordination polyedra ...) create (crystal builder, molecular library, surface creation and passivation ...) 3D atomic scale models. atomes offers a workspace capable of handling many projects opened simultaneously. The different projects in the workspace can exchange data: analysis results, atomic coordinates... atomes also provides an advanced input preparation system for further calculations using well known molecular dynamics codes: Classical MD: DLPOLY and LAMMPS - ab-initio MD: CPMD and CP2K - QM-MM MD: CPMD and CP2K To prepare the input files for these calculations is likely to be the key, and most complicated step towards MD simulations. atomes offers a user-friendly assistant to help and guide the scientist step by step to achieve this crucial step. . This package provides the binaries.