GAME - A COMPUTER-GRAPHICS METHOD FOR CALCULATING AND DISPLAYING THE MOLECULAR ELECTROSTATIC POTENTIAL

Authors
HAYD H BERGNER A PREUSS H
Citation
H. Hayd et al., GAME - A COMPUTER-GRAPHICS METHOD FOR CALCULATING AND DISPLAYING THE MOLECULAR ELECTROSTATIC POTENTIAL, Journal of molecular graphics, 13(1), 1995, pp. 2-9
Citations number
32
Categorie Soggetti
Computer Science Interdisciplinary Applications",Biology,Crystallography
Journal title
Journal of molecular graphics → ACNP
ISSN journal
02637855
Volume
13
Issue
1
Year of publication
1995
Pages
2 - 9
Database
ISI
SICI code
0263-7855(1995)13:1<2:G-ACMF>2.0.ZU;2-U
Abstract
A new method for calculating and displaying the molecular electrostati c potential on the molecular surface is described. The main advantage of the method, besides some others, is its consistency. This means one only needs one data set for the surface and the MEP: a 3D field of th e electron density from any source.