ENERGY FUNCTIONS FOR PEPTIDES AND PROTEINS .1. DERIVATION OF A CONSISTENT FORCE-FIELD INCLUDING HYDROGEN-BOND FROM AMIDE CRYSTALS

被引：727
作者：
HAGLER, AT [1 ]
HULER, E [1 ]
LIFSON, S [1 ]
机构：
[1] WEIZMANN INST SCI,CHEM PHYS DEPT,REHOVOTH,ISRAEL
来源：
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY | 1974年 / 96卷 / 17期
关键词：
D O I：
10.1021/ja00824a004
中图分类号：
O6 [化学];
学科分类号：
0703 ;
摘要：
引用
收藏
页码：5319 / 5327
页数：9
相关论文
共 61 条
[1]  
[Anonymous], 1968, ADV PHYS ORG CHEM
[2]   REFINEMENT OF THE CRYSTAL STRUCTURE OF OXAMIDE [J].
AYERST, EM ;
DUKE, JRC .
ACTA CRYSTALLOGRAPHICA, 1954, 7 (8-9) :588-590
[3]  
BADER RWF, 1967, J CHEM PHYS, V47, P3383
[4]  
BANDER A, 1958, HELV CHIM ACTA, V41, P670
[5]   CRYSTAL AND MOLECULAR STRUCTURE OF L-CIS-3,6-DIMETHYL-2,5-PIPERAZINEDIONE (L-ALANYL-L-ALANYL-2,5-DIKETOPIPERAZINE) [J].
BENEDETTI, E ;
CORRADINI, P ;
PEDONE, C .
BIOPOLYMERS, 1969, 7 (05) :751-+
[6]   VAN DER WAALS VOLUMES + RADII [J].
BONDI, A .
JOURNAL OF PHYSICAL CHEMISTRY, 1964, 68 (03) :441-+
[7]   THE VAPOUR PRESSURE AND LATTICE ENERGY OF HYDROGEN-BONDED CRYSTALS .1. OXAMIDE, OXAMIC ACID, AND RUBEANIC ACID [J].
BRADLEY, RS ;
CLEASBY, TG .
JOURNAL OF THE CHEMICAL SOCIETY, 1953, (JUN) :1681-1684
[8]  
Brant D. A., 1968, MACROMOLECULES, V1, P291
[9]   CONFORMATIONAL ENERGY ESTIMATES FOR STATISTICALLY COILING POLYPEPTIDE CHAINS [J].
BRANT, DA ;
MILLER, WG ;
FLORY, PJ .
JOURNAL OF MOLECULAR BIOLOGY, 1967, 23 (01) :47-&
[10]   CONFORMATIONAL-ANALYSIS OF BIOPOLYMERS - CONFORMATIONAL ENERGY CALCULATIONS [J].
BRANT, DA .
ANNUAL REVIEW OF BIOPHYSICS AND BIOENGINEERING, 1972, 1 :369-408
1234567