21 packages found. Page 1 of 1.

Name Version Votes Popularity? Description Maintainer
atomix-git 3.34.0.r8.gf17ff7c-1 0 0.00 Build molecules out of single atoms FredBezies
atsas 3.0.2-1 0 0.00 A program suite for small-angle scattering data analysis from biological macromolecules awacha
avogadro-git-eigen3 1.2-1 0 0.00 Molecule editor and visualizer designed for cross-platform use F_Viv
canu 1.9-1 0 0.00 Fork of the Celera Assembler, designed for high-noise single-molecule sequencing (such as the PacBio RS II/Sequel or Oxford Nanopore MinION) robymetallo
chemdoodle 11.0.0-1 2 0.00 Chemical drawing and publishing software for desktop, web and mobile (Trial) ragouel
libssm 1.4.0-3 0 0.00 A C++ toolkit for superposition of macromolecules Athemis
mgltools 1.5.6-1 3 0.00 Visualization and analysis of molecular structures; includes AutoDockTools, Vision and PythonMoleculeViewer mschu
molblocks 0.1-1 0 0.00 A suite to break small molecules into chemically meaningful fragments dviktor
packmol 20.010-1 0 0.00 Creates an initial point for molecular dynamics simulations by packing molecules in defined regions of space. berquist
pdb2pqr 2.1.1-5 0 0.00 Electrostatic and solvation properties for complex molecules dviktor
perl-chemistry-mol 0.37-1 0 0.00 Molecule object toolkit dviktor
python-imolecule 0.1.13-2 0 0.00 View molecules in the IPython notebook pozar87
python-qcelemental 0.15.1-1 0 0.00 Periodic table, physical constants, and molecule parsing for quantum chemistry berquist
vipster 1.18b-1 0 0.00 Molecule editor based on Qt, specialized on periodic structures sgsaenger
vipster-git r1302.59e41ae-1 0 0.00 Molecule editor based on Qt, specialized on periodic structures, development version sgsaenger
mgltools-bin 2015.01.22-2 1 0.00 Visualization and analysis of molecular structures; includes AutoDockTools, Vision, AutoDock 4.2.6 and PythonMoleculeViewer (includes Python 2.7) nicman23
bader 1.0.4-1 2 0.00 Quantum chemistry - Bader population analysis specter119
xdrawchem 1.10.2-1 2 0.00 XDrawChem is a two-dimensional molecule drawing program for Unix operating systems. It is similar in functionality to other molecule drawing programs such as ChemDraw (TM, CambridgeSoft). hseara
gnome-chemistry-utils 0.14.17-3 7 0.00 Gnome Chemistry Utilities (gcu). Includes gchempaint, a tool to draw molecules. shimi
apbs 1.5-4 2 0.09 Electrostatic and solvation properties for complex molecules dviktor
tarquin 4.3.12-1 1 0.23 An analysis tool for automatically determining the quantities of molecules present in MR spectroscopy data martin3141

21 packages found. Page 1 of 1.