We here propose the program VEGA, that was developed to create a bridge between the most popular molecular software packages. In this tool some features are implemented some features to analyze, display and manage the three dimensional (3D) structure of the molecules. The most important features are (1) file format conversion (with assignment of the atom types and atomic charges), (2) surface calculation and (3) trajectory analysis. The executable and the source code can be free downloaded from http://users.unimi.it/∼ddl.

VEGA: a versatile program to convert, handle and visualize molecular structure on windows-based PCs / A. Pedretti, L. Villa, G. Vistoli. - In: JOURNAL OF MOLECULAR GRAPHICS & MODELLING. - ISSN 1093-3263. - 21:1(2002 Mar 30), pp. 47-49.

VEGA: a versatile program to convert, handle and visualize molecular structure on windows-based PCs

A. Pedretti
Primo
;
L. Villa
Secondo
;
G. Vistoli
Ultimo
2002

Abstract

We here propose the program VEGA, that was developed to create a bridge between the most popular molecular software packages. In this tool some features are implemented some features to analyze, display and manage the three dimensional (3D) structure of the molecules. The most important features are (1) file format conversion (with assignment of the atom types and atomic charges), (2) surface calculation and (3) trajectory analysis. The executable and the source code can be free downloaded from http://users.unimi.it/∼ddl.
Molecular graphics; Molecular modelling; Molecular surfaces; Trajectory analysis; Data interchange
Settore CHIM/08 - Chimica Farmaceutica
30-mar-2002
Article (author)
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Utilizza questo identificativo per citare o creare un link a questo documento: https://hdl.handle.net/2434/184781
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