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61.
Adler J Becker JJ Blaylock GT Bolton T Brown JS Bunnell KO Burnett TH Cassell RE Coffman D Cook V Coward DH Dorfan DE Dubois GP Duncan AL Eigen G Einsweiler KF Eisenstein BI Freese T Gladding G Grab C Grancagnolo F Hamilton RP Hauser J Heusch CA Hitlin DG Izen JM Köpke L Li A Lockman WS Mallik U Matthews CG Mir R Mockett PM Mozley RF Nemati B Odian A Parrish L Partridge R Perrier J Pitman D Plaetzer SA Richman JD Sadrozinski HF Scarlatella M Schalk TL Schindler RH Seiden A Simopoulos C 《Physical review letters》1988,60(14):1375-1378
62.
63.
Friedrich Müller C. Morton E. C. Gilbert Cobb H. M. Partridge M. R. Thompson H. Th. St. Britton W. S. Hughes Beatrice M. Wilson W. B. Pleass A. Roche J. Roche E. B. R. Prideaux F. T. Winfield K. Drewski Fr. L. Hahn A. Petit Erich Müller F. Ishikawa T. Murooka Sho-Chow Woo Don M. Yost M. Delépine O. Stelling R. Bennewitz W. Pugh B. Stehlik N. Allen N. H. Furman I. Tananaeff L. Tronstad 《Analytical and bioanalytical chemistry》1933,95(1-3):48-57
64.
Irwin Stone Emil Fischer Lawson V. Peakes jun Joseph B. Niederl Bradley Whitman M. Boëtius Fr. Vetter M. Chaix Ivan Marek F. Pregl M. Nicloux Firmin Govaert Sh. Ogawa Wm. J. Saschek A. Friedrich E. Küs R. Schnürch S. P. L. Sorensen V. Pedersen H. Willard J. J. Thompson U. O. Oakdale Adalbert Elek Douglas W. Hill Fred E. Beamish S. W. Parr W. Münster Joseph L. Goldberg J. O. Ralls A. Soltys Shunji Tsurumi Yasaburo Sasaki Phyllis May Marrian Guy Frederic Marrian Arthur S. Williams R. H. Müller H. M. Partridge Herbert Schiedewitz J. F. Hyde H. W. Scherp Roger Adams R. L. Shriner 《Analytical and bioanalytical chemistry》1935,102(11-12):456-464
65.
Adler J Bai Z Blaylock GT Bolton T Brient J Browder TE Brown JS Bunnell KO Burchell M Burnett TH Cassell RE Coffman D Cook V Coward DH DeJongh F Dorfan DE Drinkard J Dubois GP Eigen G Einsweiler KF Eisenstein BI Freese T Gatto C Gladding G Grab C Hauser J Heusch CA Hitlin DG Izen JM Kim PC Köpke L Labs J Li A Lockman WS Mallik U Matthews CG Mincer AI Mir R Mockett PM Nemati B Odian A Parrish L Partridge R Pitman D Plaetzer SA Richman JD Sadrozinski HF Scarlatella M Schalk TL Schindler RH 《Physical review letters》1990,64(22):2615-2618
66.
Summary Energy-optimized Gaussian basis sets of triple-zeta quality for the atoms Rb-Xe have been derived. Two series of basis sets are developed; (24s 16p 10d) and (26s 16p 10d) sets which we expand to 13d and 19p functions as the 4d and 5p shells become occupied. For the atoms lighter than Cd, the (24s 16p 10d) sets with triple-zeta valence distributions are higher in energy than the corresponding double-zeta distribution. To ensure a triple-zeta distribution and a global energy minimum the (26s 16p 10d) sets were derived. Total atomic energies from the largest basis sets are between 198 and 284E
H above the numerical Hartree-Fock energies. 相似文献
67.
Benjamin R. Mullaney Benjamin E. Partridge Prof. Paul D. Beer 《Chemistry (Weinheim an der Bergstrasse, Germany)》2015,21(4):1660-1665
A systematic study on the anion‐binding properties of acyclic halogen‐ and hydrogen‐bonding bis‐triazolium carbazole receptors is described. The halide‐binding potency of halogen‐bonding bis‐iodotriazolium carbazole receptors was found to be far superior to their hydrogen‐bonding bis‐triazolium‐based analogues. This led to the synthesis of a mixed halogen‐ and hydrogen‐bonding rotaxane host containing a bis‐iodotriazolium carbazole axle component. The rotaxane’s anion recognition properties, determined by 1H NMR titration experiments in a competitive aqueous solvent mixture, demonstrated the preorganised halogen‐bonding interlocked host cavity to be halide‐selective, with a strong binding affinity for bromide. 相似文献
68.
69.
Baoguo Sun Gregory Miller Wan Yee Lee Kelvin Ho Michael A. Crowe Leslie Partridge 《Journal of chromatography. A》2013,1271(1):163-169
Analytical methods were developed for a directed enzyme evolution research programme, which pursued high performance enzymes to produce high quality l-ribose using large scale biocatalytic reaction. A high throughput HPLC method with evaporative light-scattering detection was developed to test ribose and ribitol in the enzymatic reaction, a β-cyclobond 2000 analytical column separated ribose and ribitol in 2.3 min, a C18 guard column was used as an on-line filter to clean up the enzyme sample matrix and a short gradient was applied to wash the column, the enzymatic reaction solution can be directly injected after quenching. Total run time of each sample was approx. 4 min which provided capability of screening 4 × 96-well plates/day/instrument. Meanwhile, a capillary electrophoresis method was developed for the separation of ribose enantiomers, while 7-aminonaphthalene-1,3-disulfonic acid was used as derivatisation reagent and 25 mM tetraborate with 5 mM β-cyclodextrin was used as electrolyte. 0.35%of d-ribose in l-ribose can be detected which can be translated into 99.3% ee of l-ribose. Derivatisation reagent and sample matrix did not interfere with the measurement. 相似文献
70.
Schwenke DW Partridge H 《Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy》2001,57(4):887-895
Many areas of astronomy and astrophysics require an accurate high temperature spectrum of methane (CH4). The goal of the present research is to determine an accurate ab initio potential energy surface (PES) for CH4. As a first step towards this goal, we have determined a PES including up to octic terms. We compare our results with experiment and to a PES based on a quartic expansion. Our octic PES gives good agreement with experiment for all levels, while the quartic PES only for the lower levels. 相似文献