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1.
The drawbacks of our earlier report of preparing fuel cell catalyst arrays by borohydride reduction of inkjet prepared arrays of metal salts are discussed along with the need for inclusion of state-of-the-art metrics in all array screening. An alternative method for screening of hydrogen/air cathode catalysts, direct methanol fuel cell (DMFC) anode catalysts, and catalyst loading studies is provided. State-of-the-art Johnson Matthey catalysts were used in control experiments to demonstrate the utility of the array fuel cell for high throughput screening of fuel cell catalysts in the 3-4 mg/cm2 range. This report lays out hard learned rules for high throughput screening and demonstrates that the array fuel cell can be used for very precise screening of libraries of membrane electrode assembly (MEA) components without the pitfalls discussed in the introduction. 相似文献
2.
Jesús Vázquez 《Tetrahedron letters》2006,47(10):1657-1661
Use of a semicarbazide resin for the solid-phase preparation of peptide ketones and aldehyde led to optimal results in terms of both purity of the final product and overall yield. This resin was prepared without complication by activation of the commercial available aminomethyl polystyrene with CDI at room temperature, followed by treatment with tert-butyl carbazate. Furthermore, the TNBSA colorimetric assay has been adapted for checking the incorporation of the carbonyl moiety onto hydrazine-based resins. 相似文献
3.
Searching in trees 总被引:1,自引:0,他引:1
Frank Recker 《Discrete Applied Mathematics》2004,140(1-3):169-183
In (Discrete Math. 17 (1977)181) Rivest introduced the search complexity of binary trees and proved that among all binary trees with a fixed search complexity the smallest ones are the so-called Fibonacci trees. This result is extended for q-trees. The structure of the smallest q-trees is again Fibonacci-like but more complicated than in the binary case. In addition an upper bound for the asymptotic growth of these trees is given. 相似文献
4.
Let G=(V,E) be a undirected k-edge connected graph with weights ce on edges and wv on nodes. The minimum 2-edge connected subgraph problem, 2ECSP for short, is to find a 2-edge connected subgraph of G, of minimum total weight. The 2ECSP generalizes the well-known Steiner 2-edge connected subgraph problem. In this paper we study the convex hull of the incidence vectors corresponding to feasible solutions of 2ECSP. First, a natural integer programming formulation is given and it is shown that its linear relaxation is not sufficient to describe the polytope associated with 2ECSP even when G is series-parallel. Then, we introduce two families of new valid inequalities and we give sufficient conditions for them to be facet-defining. Later, we concentrate on the separation problem. We find polynomial time algorithms to solve the separation of important subclasses of the introduced inequalities, concluding that the separation of the new inequalities, when G is series-parallel, is polynomially solvable. 相似文献
5.
6.
Future pathways for combinatorial chemistry 总被引:1,自引:0,他引:1
David Brown 《Molecular diversity》1997,2(4):217-222
Summary Investment in combinatorial chemistry (combichem) in the pharmaceutical industry is being driven by the need for increased efficiency. Results from pioneers in the field have demonstrated where mixture or discrete compound synthesis is useful, and what mixture sizes and compound concentrations are appropriate. To make the techniques of combichem of general utility in drug discovery, a broad range of advances is still required. Conversion of organic chemistry to solid phase conditions is key, as are developments in linkers and resins. Library design methodology requires further development. Combinatorial biosynthesis of focused libraries of natural products holds great promise for capitalising on hardwon natural product leads. Miniaturisation of screens is required to reduce the cost of screening combinatorial libraries. Developments in the processes preceding and following synthesis are required to enable the flow of increased numbers of compounds without new bottlenecks developing. The impact of combinatorial chemistry will be greatly enhanced by synergy with ongoing parallel developments in genetic technologies, screening technologies and bioinformatics. 相似文献
7.
We study a variation of the knapsack problem in which each item has a profit, a weight and a penalty; the sum of profits of the selected items minus the largest penalty associated with the selected items must be maximized. We present an ILP formulation and an exact optimization algorithm. 相似文献
8.
Bram van Asch Henk Hollmann Henk van Tilborg 《Journal of Combinatorial Theory, Series A》2006,113(8):1594-1613
When Jack van Lint was appointed as full professor at the Eindhoven University of Technology at the age of 26 he combined a PhD in number theory with a very open scientific mind. It took a sabbatical visit to Bell Laboratories in 1966 to make him understand that a new and fascinating field of applied mathematics was emerging: discrete mathematics. It fascinated and inspired him for the rest of his life. When he passed away on September 28, 2004, he left behind a legacy of 18 books and 177 articles, covering many aspects of coding theory, combinatorics, and finite geometry.van Lint was also a strong international advocate of the role that discrete mathematics ought to play in modern applied mathematics curricula. Quite a few departments sought his advice. Years later, four different universities showed their appreciation by awarding him an honorary degree.This overview is an homage to van Lint's academic achievements and can serve as an introduction to his work for younger generations. 相似文献
9.
Recently, we have developed a new tight-binding quantum chemical molecular dynamics program “Colors” for combinatorial computational chemistry approach. This methodology is based on our original tight-binding approximation and realized over 5000 times acceleration compared to the conventional first-principles molecular dynamics method. In the present study, we applied our new program to the simulations on various realistic large-scale models of the automotive three-way catalysts, ultrafine Pt particle/CeO2(111) support. Significant electron transfer from the Pt particle to the CeO2(111) surface was observed and it was found to strongly depend on the size of the Pt particle. Furthermore, our simulation results suggest that the reduction of the Ce atom due to the electron transfer from the Pt particle to the CeO2 surface is a main reason for the strong interaction of the Pt particle and CeO2(111) support. 相似文献
10.