ABINITIO THEORY OF HYDROGEN-BONDING IN VITAMIN-B6

被引:7
作者
GREENWOOD, HH
PLANT, JS
机构
关键词
D O I
10.1002/qua.560300113
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
引用
收藏
页码:127 / 136
页数:10
相关论文
共 24 条
[1]   INTERRELATIONS BETWEEN ELECTRONIC-STRUCTURE AND SPATIAL GEOMETRY OF SPECIFIC LIGANDS IN THE FUNCTIONING ACTIVE-SITE OF SOME PYRIDOXAL-PARA-DEPENDENT ENZYMES [J].
ALMAZOV, VP ;
MOROZOV, YV ;
SAVIN, FA ;
SUKHAREVA, BS .
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 1979, 16 (04) :769-775
[2]   NEUTRON STRUCTURAL REFINEMENT FOR PYRIDOXINIUM CHLORIDE, A COMPONENT C8H12CLNO3 OF THE VITAMIN-B6 [J].
BACON, GE ;
PLANT, JS .
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE, 1980, 36 (MAY) :1130-1136
[3]   CALCULATION OF SMALL MOLECULAR INTERACTIONS BY DIFFERENCES OF SEPARATE TOTAL ENERGIES - SOME PROCEDURES WITH REDUCED ERRORS [J].
BOYS, SF ;
BERNARDI, F .
MOLECULAR PHYSICS, 1970, 19 (04) :553-&
[4]  
BRINKLEY JS, 1978, QCPE, V10, P368
[5]  
CHOJNACKI H, 1981, INT J QUANTUM CHEM, V19, P339
[7]   STUDY OF ELECTRONIC STRUCTURE OF MOLECULES .7. INNER AND OUTER COMPLEX IN NH4CL FORMATION FROM NH3 AND HCL [J].
CLEMENTI, E ;
GAYLES, JN .
JOURNAL OF CHEMICAL PHYSICS, 1967, 47 (10) :3837-&
[9]  
CLEMENTI E, 1971, J CHEM PHYS, V54, P503
[10]  
CLEMENTI E, 1982, INT J QUANTUM CHEM Q, V9, P213