NEW APPROACH TO EMPIRICAL INTERMOLECULAR AND CONFORMATIONAL POTENTIAL-ENERGY FUNCTIONS .2. APPLICATIONS TO CRYSTAL PACKING, ROTATIONAL BARRIERS, AND CONFORMATIONAL-ANALYSIS

被引：33

作者：

BURGESS, AW

SHIPMAN, LL

SCHERAGA, HA

机构：

[1] CORNELL UNIV,DEPT CHEM,ITHACA,NY 14853

[2] WEIZMANN INST SCI,DEPT BIOPHYS,REHOVOTH,ISRAEL

来源：

PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA | 1975年 / 72卷 / 03期

关键词：

D O I：

10.1073/pnas.72.3.854

中图分类号：

O [数理科学和化学]; P [天文学、地球科学]; Q [生物科学]; N [自然科学总论];

学科分类号：

07 ; 0710 ; 09 ;

摘要：

引用

页码：854 / 858

页数：5

共 50 条

[1]

[Anonymous], 1968, ADV PHYS ORG CHEM

[2] ON THE CRYSTAL STRUCTURES OF METHYLAMINE [J].

ATOJI, M ;

LIPSCOMB, WN .

ACTA CRYSTALLOGRAPHICA, 1953, 6 (10) :770-774

[3] LATTICE VIBRATIONS OF MOLECULAR CRYSTALS .3. SPECTRUM, DYNAMICS AND LATTICE ENERGY OF METHYLAMINE SYSTEM [J].

BAGLIN, FG ;

BUSH, SF ;

DURIG, JR .

MOLECULAR CRYSTALS AND LIQUID CRYSTALS, 1969, 5 (04) :331-&

[4] THE DEPENDENCE ON STATE OF THE APPARENT DIPOLE MOMENTS OF ETHYLAMINE, DIETHYLAMINE AND TRIETHYLAMINE [J].

BARCLAY, GA ;

LEFEVRE, RJW ;

SMYTHE, BM .

TRANSACTIONS OF THE FARADAY SOCIETY, 1950, 46 (10) :812-820

[5] HEAT CAPACITY, GAS IMPERFECTION, INFRARED SPECTRA, AND INTERNAL ROTATION BARRIERS OF ETHYL ALCOHOL [J].

BARROW, GM .

JOURNAL OF CHEMICAL PHYSICS, 1952, 20 (11) :1739-1744

[6] THERMODYNAMIC PROPERTIES OF 2-METHYL-2-PROPANOL [J].

BEYNON, ET ;

MCKETTA, JJ .

JOURNAL OF PHYSICAL CHEMISTRY, 1963, 67 (12) :2761-&

[7] ALPHA-D-GLUCOSE - DETERMINATION OF CRYSTAL AND MOLECULAR STRUCTURE BY NEUTRON-DIFFRACTION ANALYSIS [J].

BROWN, GM ;

LEVY, HA .

SCIENCE, 1965, 147 (3661) :1038-&

[8]

CAJORI T, 1919, HISTORY MATH, P203

[9] LOW-FREQUENCY MODES IN MOLECULAR CRYSTALS .6. METHYL TORSIONS AND BARRIERS TO INTERNAL ROTATION OF C(CH3)4, C(CD3)4, SI(CH3)4, GE(CH3)4, AND SN(CH3)4 [J].

DURIG, JR ;

CRAVEN, SM ;

BRAGIN, J .

JOURNAL OF CHEMICAL PHYSICS, 1970, 52 (04) :2046-&

[10] SEMIEMPIRICAL ENERGY CALCULATIONS ON MODEL COMPOUNDS OF POLYPEPTIDES - CRYSTAL-STRUCTURES OF DL-ACETYLLEUCINE N-METHYLAMIDE AND DL-ACETYL-AMINOBUTYRIC ACID N-METHYLAMIDE [J].

FERRO, DR .

BIOPOLYMERS, 1972, 11 (01) :105-&

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