共 17 条
- [1] THE LOCAL DEFINITION OF THE OPTIMUM ASCENT PATH ON A MULTIDIMENSIONAL POTENTIAL-ENERGY SURFACE AND ITS PRACTICAL APPLICATION FOR THE LOCATION OF SADDLE POINTS[J]. CHEMICAL PHYSICS, 1981, 60 (03) : 347 - 358BASILEVSKY, MVSHAMOV, AG
- [2] ANALYTICAL FUNCTIONS FOR THE GROUND-STATE POTENTIAL SURFACES OF C3(X 1SIGMA-G+) AND HCN(X 1SIGMA+)[J]. JOURNAL OF MOLECULAR SPECTROSCOPY, 1980, 81 (01) : 110 - 121CARTER, SMILLS, IMMURRELL, JN
- [3] ON FINDING TRANSITION-STATES[J]. JOURNAL OF CHEMICAL PHYSICS, 1981, 75 (06) : 2800 - 2806CERJAN, CJMILLER, WH
- [4] PHOTOFRAGMENT SPECTRUM OF C-STATE HCN - THEORETICAL INTERPRETATION[J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1982, 104 (03) : 646 - 652CHULJIAN, DTSIMONS, J
- [5] MINIMIZATION OF POLYPEPTIDE ENERGY .11. METHOD OF GENTLEST ASCENT[J]. ARCHIVES OF BIOCHEMISTRY AND BIOPHYSICS, 1971, 144 (02) : 462 - &CRIPPEN, GMSCHERAGA, HA
- [6] DENNIS JE, 1974, MATH COMPUT, V28, P549, DOI 10.1090/S0025-5718-1974-0343581-1
- [7] Fletcher R., 1980, PRACTICAL METHODS OP, V1
- [8] GOLAB J, UNPUB CHEM PHYS
- [9] SYNCHRONOUS-TRANSIT METHOD FOR DETERMINING REACTION PATHWAYS AND LOCATING MOLECULAR TRANSITION-STATES[J]. CHEMICAL PHYSICS LETTERS, 1977, 49 (02) : 225 - 232HALGREN, TALIPSCOMB, WN
- [10] APPLICATION OF NEWTON-RAPHSON OPTIMIZATION TECHNIQUES IN MOLECULAR MECHANICS CALCULATIONS[J]. COMPUTERS & CHEMISTRY, 1977, 1 (03): : 179 - 186HILDERBRANDT, RL