THEORETICAL CALCULATION OF RELATIVE BINDING-AFFINITY IN HOST GUEST SYSTEMS

被引：217

作者：

LYBRAND, TP ^{[1
]}

MCCAMMON, JA ^{[1
]}

WIPFF, G ^{[1
]}

机构：

[1] UNIV STRASBOURG 1, INST CHEM, F-67008 STRASBOURG, FRANCE

来源：

PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA | 1986年 / 83卷 / 04期

关键词：

D O I：

10.1073/pnas.83.4.833

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：833 / 835

页数：3

共 22 条

[1] HYDRATION OF HALIDE NEGATIVE IONS IN GAS PHASE .2. COMPARISON OF HYDRATION ENERGIES FOR ALKALI POSITIVE AND HALIDE NEGATIVE IONS
ARSHADI, M
YAMDAGNI, R
KEBARLE, P
[J]. JOURNAL OF PHYSICAL CHEMISTRY, 1970, 74 (07) : 1475 - &
[2] Berendsen H. J. C., 1981, INTERMOLECULAR FORCE, P331, DOI [DOI 10.1007/978-94-015-7658-1_21, DOI 10.1007/978-94-015-7658-1-21]
[3] MOLECULAR-DYNAMICS WITH COUPLING TO AN EXTERNAL BATH
BERENDSEN, HJC
POSTMA, JPM
VANGUNSTEREN, WF
DINOLA, A
HAAK, JR
[J]. JOURNAL OF CHEMICAL PHYSICS, 1984, 81 (08) : 3684 - 3690
[4] SODIUM-CHLORIDE ION-PAIR INTERACTION IN WATER - COMPUTER-SIMULATION
BERKOWITZ, M
KARIM, OA
MCCAMMON, JA
ROSSKY, PJ
[J]. CHEMICAL PHYSICS LETTERS, 1984, 105 (06) : 577 - 580
[5] THEORETICAL-EXAMINATION OF THE SN2 REACTION INVOLVING CHLORIDE-ION AND METHYL-CHLORIDE IN THE GAS-PHASE AND AQUEOUS-SOLUTION
CHANDRASEKHAR, J
SMITH, SF
JORGENSEN, WL
[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1985, 107 (01) : 154 - 163
[6] STRUCTURAL BASIS OF ANTIBODY FUNCTION
DAVIES, DR
METZGER, H
[J]. ANNUAL REVIEW OF IMMUNOLOGY, 1983, 1 : 87 - 117
[7] Fersht A, 1985, ENZYME STRUCTURE MEC
[8] FRIEDMAN HL, 1972, WATER COMPREHENSIVE, V3, P1
[9] ANION CRYPTATES - HIGHLY STABLE AND SELECTIVE MACROTRICYCLIC ANION INCLUSION COMPLEXES
GRAF, E
LEHN, JM
[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1976, 98 (20) : 6403 - 6405
[10] MONTE-CARLO SIMULATION OF DIFFERENCES IN FREE-ENERGIES OF HYDRATION
JORGENSEN, WL
RAVIMOHAN, C
[J]. JOURNAL OF CHEMICAL PHYSICS, 1985, 83 (06) : 3050 - 3054

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