COMPUTING SMOOTH MOLECULAR-SURFACES

被引：153

作者：

VARSHNEY, A

BROOKS, FP

WRIGHT, WV

机构：

[1] University of North Carolina, Chapel Hill

来源：

IEEE COMPUTER GRAPHICS AND APPLICATIONS | 1994年 / 14卷 / 05期

基金：

美国国家科学基金会;

关键词：

D O I：

10.1109/38.310720

中图分类号：

TP31 [计算机软件];

学科分类号：

081202 ; 0835 ;

摘要：

We have developed an algorithm for efficiently computing a smooth molecular surface. Our algorithm parallelizes easily and scales linearly with the number of atoms in a molecule.

引用

页码：19 / 25

页数：7

共 14 条

[1] POWER DIAGRAMS - PROPERTIES, ALGORITHMS AND APPLICATIONS [J].

AURENHAMMER, F .

SIAM JOURNAL ON COMPUTING, 1987, 16 (01) :78-96

[2] ANALYTICAL MOLECULAR-SURFACE CALCULATION [J].

CONNOLLY, ML .

JOURNAL OF APPLIED CRYSTALLOGRAPHY, 1983, 16 (OCT) :548-558

[3]

Dickerson RE, 1969, STRUCTURE ACTION PRO

[4] 3-DIMENSIONAL ALPHA-SHAPES [J].

EDELSBRUNNER, H ;

MUCKE, EP .

ACM TRANSACTIONS ON GRAPHICS, 1994, 13 (01) :43-72

[5]

EDELSBRUNNER H, 1983, IEEE T INFORM THEORY, V29, P551, DOI 10.1109/TIT.1983.1056714

[6]

EDELSBRUNNER H, 1992, IUIUCDCSR921760 U IL

[7]

Fuchs H., 1989, Computer Graphics, V23, P79, DOI 10.1145/74334.74341

[8] MSEED - A PROGRAM FOR THE RAPID ANALYTICAL DETERMINATION OF ACCESSIBLE SURFACE-AREAS AND THEIR DERIVATIVES [J].

PERROT, G ;

CHENG, B ;

GIBSON, KD ;

VILA, J ;

PALMER, KA ;

NAYEEM, A ;

MAIGRET, B ;

SCHERAGA, HA .

JOURNAL OF COMPUTATIONAL CHEMISTRY, 1992, 13 (01) :1-11

[9]

Preparata F. P., 2012, COMPUTATIONAL GEOMET

[10] AREAS, VOLUMES, PACKING, AND PROTEIN-STRUCTURE [J].

RICHARDS, FM .

ANNUAL REVIEW OF BIOPHYSICS AND BIOENGINEERING, 1977, 6 :151-176

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