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Molarity is a simple application that enables you to ... drinks' concentration. What determines the concentration of a solution? What determines the concentration of a solution? Learn about the relationships between moles, liters, and ...

Gabedit is a graphical user interface to computational chemistry packages like Gamess-US, Gaussian, Molcas, Molpro, MPQC, OpenMopac, Orca, PCGamess and Q-Chem It can display a variety of calculation results ...

Open Babel is a chemical toolbox designed to speak the many languages of chemical data. It's an open, collaborative project allowing anyone ... convert, analyze, or store data from molecular modeling, chemistry, biochemistry, or related areas Features: Ready-to-use ...

... Java based application designed to display various 3D chemical information. Jmol's features include reading a variety of file types and output from quantum chemistry programs, and animation of multi-frame files and computed ...

Espresso ELN is a fully featured chemistry electronic lab notebook (ELN) suited for organic, organometallic, polymer and peptide chemistry, featuring a strong protocol editor, detection of synthetic ... to physical data, patents, spectra, etc.) · Integrated chemical drawing editor, with copy/paste support for ISIS/Draw and ...

... also extents its applicable range to general organic chemistry with its user definable fragment database. Give aminoXpress a try to fully assess its capabilities! ...

Toxtree is a full-featured and flexible user-friendly open source application, which is able to estimate toxic hazard by applying a decision tree approach. Toxtree could be applied to datasets from ...

Toxtree is a full-featured and flexible user-friendly open source application, which is able to estimate toxic hazard by applying a decision tree approach. Toxtree could be applied to datasets from ...

... imported as SDF file 2. Optionally, for each compound of the dataset a quenched molecular dynamics (QMD) ... the global minimum 3. One or more template compounds are chosen, then the whole dataset is best-aligned ...

... systematically varying the coordinates of ligands relevant to Chemistry and biology, to easily calculate and evaluate structural effects in EXAFS/XAS and XES ...