公开(公告)号：AT213851T

公开(公告)日：2002-03-15

申请号：AT99955064

申请日：1999-10-19

Applicant: SYMYX TECHNOLOGIES INC

Inventor： LACY STEVEN D ,  MCFARLAND ERIC W ,  SAFIR ADAM L ,  TURNER STEPHEN J ,  VAN ERDEN LYNN ,  WANG PEI

IPC: B01J19/00 ,  C07B61/00 ,  C40B50/02 ,  C40B60/14 ,  G06F17/50 ,  G06F19/00

Abstract: A computer-implemented method for generating a library design for a combinatorial library of materials, a combinatorial library being a collection of two or more members that contain some variance in chemical composition, chemical amount, reaction conditions, and/or processing conditions, a member being a single position in a library, the method comprising: defining a set of one or more sources and one or more destinations, each source being electronic data representing a component to be used in preparing the combinatorial library and each destination being electronic data representing a conceptual arrangement of cells representing a combinatorial library, the cells corresponding to members of the combinatorial library and/or locations on a physical substrate; defining one or more mappings, the mappings in the aggregate defining a composition for each of a plurality of materials assigned to a plurality of cells in the arrangement; defining one or more parameters, each parameter being electronic data being electronic data corresponding to a process condition to be applied to one or more cells of the arrangement representing the combinatorial library; defining one or more parameter values for each of the parameters, the parameter values representing an amount of the corresponding process condition to be applied to one or more of the cells of the arrangement; and generating a data file defining the library design, the data file comprising electronic data describing the source elements, the destination elements, the mappings, the parameters and the parameter values.

公开(公告)号：CA2343534C

公开(公告)日：2007-09-25

申请号：CA2343534

申请日：1999-10-19

Applicant: SYMYX TECHNOLOGIES INC

Inventor： LACY STEVEN D ,  SAFIR ADAM L ,  MCFARLAND ERIC W ,  TURNER STEPHEN J ,  VAN ERDEN LYNN ,  WANG PEI

IPC: G01N37/00 ,  G06F17/40 ,  C07B61/00 ,  C40B30/00 ,  C40B30/02 ,  C40B50/00 ,  C40B50/02 ,  C40B60/00 ,  C40B60/14 ,  G06F17/50

Abstract: Computer-implemented methods, programs and apparatus for generating a librar y design for a combinatorial library of materials. A library design includes a set of sources representing components to be used in preparing the combinatorial library, destinations representing arrangements of cells and mappings, defining one or more distribution patter ns for assigning components to cells in the destination arrangement or arrangements. Mappings include gradients and sets of user- defined equations, and are used to calculate the amount of one or more components to be assigned to a cell or cells in an arrangement. A library design can also include one or more process parameters defined to vary over time or across a plurality of destination cells. The invention outputs a data file defining the library design, including electronic data representing the sources, the destinations and the mapping, in a format suitable for implementing manually or using automated material handling apparatus.

公开(公告)号：DK1080435T3

公开(公告)日：2002-06-17

申请号：DK99955064

申请日：1999-10-19

Applicant: SYMYX TECHNOLOGIES INC

Inventor： LACY STEVEN D ,  MCFARLAND ERIC W ,  TURNER STEPHEN J ,  VAN ERDEN LYNN ,  WANG PEI ,  SAFIR ADAM L

IPC: B01J19/00 ,  C07B61/00 ,  C40B50/02 ,  C40B60/14 ,  G06F17/50 ,  G06F19/00

Abstract: A computer-implemented method for generating a library design for a combinatorial library of materials, a combinatorial library being a collection of two or more members that contain some variance in chemical composition, chemical amount, reaction conditions, and/or processing conditions, a member being a single position in a library, the method comprising: defining a set of one or more sources and one or more destinations, each source being electronic data representing a component to be used in preparing the combinatorial library and each destination being electronic data representing a conceptual arrangement of cells representing a combinatorial library, the cells corresponding to members of the combinatorial library and/or locations on a physical substrate; defining one or more mappings, the mappings in the aggregate defining a composition for each of a plurality of materials assigned to a plurality of cells in the arrangement; defining one or more parameters, each parameter being electronic data being electronic data corresponding to a process condition to be applied to one or more cells of the arrangement representing the combinatorial library; defining one or more parameter values for each of the parameters, the parameter values representing an amount of the corresponding process condition to be applied to one or more of the cells of the arrangement; and generating a data file defining the library design, the data file comprising electronic data describing the source elements, the destination elements, the mappings, the parameters and the parameter values.

公开(公告)号：CA2431066C

公开(公告)日：2007-05-15

申请号：CA2431066

申请日：2001-12-17

Applicant: SYMYX TECHNOLOGIES INC

Inventor： TURNER STEPHEN J ,  FALCIONI MARCO ,  RAMBERG ERIC C ,  WANG YOUQI

IPC: G06G7/58 ,  G06F17/50 ,  G06F19/00

Abstract: Computer-implemented methods, system and apparatus, including computer progr am apparatus, provide techniques for designing a set of experiments to be performed with a set of resources. A plurality of experimental configuration s (800) are generated based on a set of parameters describing factors to be varied in the experiments and a set of constraints representing limitations on operations that can be performed with the set of resources. A set of experiments is defined based on a selected configuration. The constraints ca n be represented as patterns (810) defining an application of a parameter to a set of one or more points of an experimental lattice.

公开(公告)号：AU3098102A

公开(公告)日：2002-06-24

申请号：AU3098102

申请日：2001-12-17

Applicant: SYMYX TECHNOLOGIES INC

Inventor： WANG YOUQI ,  FALCIONI MARCO ,  TURNER STEPHEN J ,  RAMBERG ERIC C

IPC: G06F17/50 ,  G06F19/00

Abstract: Computer-implemented methods, systems and apparatus, including computer program apparatus, provide techniques for designing a set of experiments to be performed with a set of resources. A plurality of experimental configurations are generated based on a set of parameters describing factors to be varied in the experiments and a set of constraints representing limitations on operations that can be performed with the set of resources. A set of experiments is defined based on a selected configuration. The constraints can be represented as patterns defining an application of a parameter to a set of one or more points of an experimental lattice.

公开(公告)号：CA2431066A1

公开(公告)日：2002-06-20

申请号：CA2431066

申请日：2001-12-17

Applicant: SYMYX TECHNOLOGIES INC

Inventor： FALCIONI MARCO ,  WANG YOUQI ,  TURNER STEPHEN J ,  RAMBERG ERIC C

IPC: G06F17/50 ,  G06F19/00 ,  G06G7/58

Abstract: Computer-implemented methods, system and apparatus, including computer progr am apparatus, provide techniques for designing a set of experiments to be performed with a set of resources. A plurality of experimental configuration s (800) are generated based on a set of parameters describing factors to be varied in the experiments and a set of constraints representing limitations on operations that can be performed with the set of resources. A set of experiments is defined based on a selected configuration. The constraints ca n be represented as patterns (810) defining an application of a parameter to a set of one or more points of an experimental lattice.

公开(公告)号：AU1125500A

公开(公告)日：2000-05-08

申请号：AU1125500

申请日：1999-10-19

Applicant: SYMYX TECHNOLOGIES INC

Inventor： LACY STEVEN D ,  MCFARLAND ERIC W ,  SAFIR ADAM L ,  TURNER STEPHEN J ,  ERDEN LYNN VAN ,  WANG PEI

IPC: B01J19/00 ,  C07B61/00 ,  C40B50/02 ,  C40B60/14 ,  G06F17/50 ,  G06F19/00

Abstract: A computer-implemented method for generating a library design for a combinatorial library of materials, a combinatorial library being a collection of two or more members that contain some variance in chemical composition, chemical amount, reaction conditions, and/or processing conditions, a member being a single position in a library, the method comprising: defining a set of one or more sources and one or more destinations, each source being electronic data representing a component to be used in preparing the combinatorial library and each destination being electronic data representing a conceptual arrangement of cells representing a combinatorial library, the cells corresponding to members of the combinatorial library and/or locations on a physical substrate; defining one or more mappings, the mappings in the aggregate defining a composition for each of a plurality of materials assigned to a plurality of cells in the arrangement; defining one or more parameters, each parameter being electronic data being electronic data corresponding to a process condition to be applied to one or more cells of the arrangement representing the combinatorial library; defining one or more parameter values for each of the parameters, the parameter values representing an amount of the corresponding process condition to be applied to one or more of the cells of the arrangement; and generating a data file defining the library design, the data file comprising electronic data describing the source elements, the destination elements, the mappings, the parameters and the parameter values.

公开(公告)号：CA2343534A1

公开(公告)日：2000-04-27

申请号：CA2343534

申请日：1999-10-19

Applicant: SYMYX TECHNOLOGIES INC

Inventor： MCFARLAND ERIC W ,  WANG PEI ,  SAFIR ADAM L ,  VAN ERDEN LYNN ,  TURNER STEPHEN J ,  LACY STEVEN D

IPC: G01N37/00 ,  C07B61/00 ,  C40B30/00 ,  C40B30/02 ,  C40B50/02 ,  C40B60/00 ,  G06F17/50

Abstract: Computer-implemented methods, programs and apparatus for generating a librar y design for a combinatorial library of materials. A library design includes a set of sources representing components to be used in preparing the combinatorial library, destinations representing arrangements of cells and mappings, defining one or more distribution patterns for assigning component s to cells in the destination arrangement or arrangements. Mappings include gradients and sets of user-defined equations, and are used to calculate the amount of one or more components to be assigned to a cell or cells in an arrangement. A library design can also include one or more process parameter s defined to vary over time or across a plurality of destination cells. The invention outputs a data file defining the library design, including electronic data representing the sources, the destinations and the mapping, in a format suitable for implementing manually or using automated material handling apparatus.

公开(公告)号：WO0248841A3

公开(公告)日：2003-03-13

申请号：PCT/US0148889

申请日：2001-12-17

Applicant: SYMYX TECHNOLOGIES INC

Inventor： WANG YOUQI ,  FALCIONI MARCO ,  TURNER STEPHEN J ,  RAMBERG ERIC C

IPC: G06F17/50 ,  G06F19/00 ,  G06G7/58

CPC classification number: C40B50/02 ,  B01J2219/00605 ,  B01J2219/00621 ,  B01J2219/00659 ,  B01J2219/00689 ,  B01J2219/00695 ,  B01J2219/007

Abstract: Computer-implemented methods, system and apparatus, including computer program apparatus, provide techniques for designing a set of experiments to be performed with a set of resources. A plurality of experimental configurations (800) are generated based on a set of parameters describing factors to be varied in the experiments and a set of constraints representing limitations on operations that can be performed with the set of resources. A set of experiments is defined based on a selected configuration. The constraints can be represented as patterns (810) defining an application of a parameter to a set of one or more points of an experimental lattice.

Abstract translation: 计算机实现的方法，系统和装置，包括计算机程序设备，提供用于设计要用一组资源执行的一组实验的技术。 基于描述在实验中变化的因素的一组参数和表示可以利用该组资源来执行的操作的限制的一组约束来生成多个实验配置（800）。 基于所选配置定义一组实验。 限制可以表示为定义将参数应用于实验网格的一个或多个点的集合的模式（810）。

公开(公告)号：WO0023921A9

公开(公告)日：2000-11-16

申请号：PCT/US9924491

申请日：1999-10-19

Applicant: SYMYX TECHNOLOGIES INC

Inventor： LACY STEVEN D ,  MCFARLAND ERIC W ,  SAFIR ADAM L ,  TURNER STEPHEN J ,  VAN ERDEN LYNN ,  WANG PEI

IPC: B01J19/00 ,  C07B61/00 ,  C40B50/02 ,  C40B60/14 ,  G06F17/50 ,  G06F19/00

CPC classification number: C40B50/02 ,  B01J19/0046 ,  B01J2219/00477 ,  B01J2219/00479 ,  B01J2219/00495 ,  B01J2219/00689 ,  B01J2219/00695 ,  B01J2219/00698 ,  B01J2219/007 ,  C40B60/14

Abstract: Computer-implemented methods, programs and apparatus for generating a library design for a combinatorial library of materials. A library design includes a set of sources representing components to be used in preparing the combinatorial library, destinations representing arrangements of cells and mappings, defining one or more distribution patterns for assigning components to cells in the destination arrangement or arrangements. Mappings include gradients and sets of user-defined equations, and are used to calculate the amount of one or more components to be assigned to a cell or cells in an arrangement. A library design can also include one or more process parameters defined to vary over time or across a plurality of destination cells. The invention outputs a data file defining the library design, including electronic data representing the sources, the destinations and the mapping, in a format suitable for implementing manually or using automated material handling apparatus.

Abstract translation: 用于为材料组合库生成库设计的计算机实现的方法，程序和装置。 库设计包括一组表示用于准备组合库的组件的源，代表单元和映射的布置的目的地，定义用于将组件分配给目的地布置中的单元的一个或多个分布模式。 映射包括梯度和用户定义的方程组，用于计算一个或多个要分配给一个或多个单元的组件的数量。 库设计还可以包括定义为随着时间或跨多个目标单元而变化的一个或多个过程参数。 本发明输出定义库设计的数据文件，该文件包括表示源，目的地和映射的电子数据，其格式适合手动实现或使用自动化材料处理装置。