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1. 发明申请

WO2010056109A1 SAMPLE ANALYSIS APPARATUS AND A METHOD OF ANALYSING A SAMPLE 审中-公开
标题翻译：样品分析仪器和分析样品的方法
公开(公告)号：WO2010056109A1
公开(公告)日：2010-05-20
申请号：PCT/NL2009/000208
申请日：2009-11-02
申请人： AVANTIUM HOLDING B.V. , McKAY, Benjamin , BENTSCHAP KNOOK, Dirk, François , VAN BANNING, Srephan, Olivier , COETZEE, Anita
发明人： McKAY, Benjamin , BENTSCHAP KNOOK, Dirk, François , VAN BANNING, Srephan, Olivier , COETZEE, Anita
IPC分类号： G01N21/51 , G01N21/03 , G01N15/02 , G01N21/82 , G01N21/65 , G01N21/53
CPC分类号： G01N21/51 , G01N15/0227 , G01N21/0332 , G01N21/532 , G01N21/534 , G01N21/82 , G01N2021/651 , G01N2201/062 , G01N2201/063
摘要： The invention relates to a sample analysis apparatus. The apparatus comprises: a radiation system to irradiate the sample in a vial and an analyser with a camera to analyse the radiation received from the sample in the vial. The apparatus is provided with a holder to releasable hold the vial and with an optical path for the radiation system to irradiate the sample and for the camera to make images of the sample. The radiation system can be used for front lighting of the sample in the vial or for back lighting of the sample in the vial. The camera may be provided with a telecentric lens.
摘要翻译：样本分析装置技术领域本发明涉及一种样本分析装置。该设备包括：辐射系统，用于照射小瓶中的样品和具有照相机的分析仪，以分析从小瓶中的样品接收到的辐射。该设备设置有保持器，该保持器可释放地保持小瓶并且具有用于辐射系统照射样本并且用于相机制作样本图像的光路。辐射系统可用于小瓶中样品的正面照明或小瓶中样品的背面照明。相机可能配有远心镜头。

2. 发明申请

WO2008035959A1 METHOD TO DERIVE A COMPOSITION OF A SAMPLE 审中-公开
标题翻译：诱导样品组合物的方法
公开(公告)号：WO2008035959A1
公开(公告)日：2008-03-27
申请号：PCT/NL2006/000462
申请日：2006-09-18
申请人： AVANTIUM INTERNATIONAL B.V. , McKAY, Benjamin
发明人： McKAY, Benjamin
IPC分类号： G01N23/20
CPC分类号： G01N23/20
摘要： The invention comprises a method to derive a composition of a sample of a plurality of samples. Each sample comprises at least one substance of a plurality of substances. In a first step a diffraction pattern measurement is performed on each sample of the plurality of samples to obtain a plurality of diffraction patterns. Further, in the plurality of diffraction patterns correlations between the properties in the diffraction patterns and grouping the diffraction patterns based on the determined correlations are determined. Still further, a subset of the diffraction patterns is selected, the subset comprising diffraction patterns from each of the groups. Diffraction patterns of pure forms of the substances are estimated, which comprises determining an estimate of diffraction patterns of the pure forms of the substances, determining estimated diffraction patterns by relating the diffraction patterns of the subset with patterns reconstructed using the estimated diffraction patterns, given estimates of the concentrations of each of the substances, estimating concentration profiles of the subset of diffraction patterns by relating the diffraction patterns of the subset with patterns reconstructed using the estimated diffraction patterns, given estimates of the diffraction patterns of the pure forms. Also, the method comprises fitting the obtained diffraction patterns of pure forms of the substances with the diffraction patterns of the samples to determine which of the substances is present in each of the samples.
摘要翻译：本发明包括导出多个样品的样品的组成的方法。每个样品包含多种物质的至少一种物质。在第一步骤中，对多个样品的每个样品进行衍射图案测量以获得多个衍射图案。此外，在多个衍射图案中，确定衍射图案中的特性和基于所确定的相关性对衍射图案进行分组之间的相关性。此外，选择衍射图案的子集，该子集包括来自每个组的衍射图案。估计纯形式的物质的衍射图案，其包括确定物质的纯形式的衍射图案的估计，通过将子集的衍射图案与使用估计的衍射图案重建的图案相关联来确定估计的衍射图案，给出估计的每种物质的浓度，通过将子集的衍射图案与使用估计的衍射图案重建的图案相关联来估计衍射图案子集的浓度分布，给出纯形式的衍射图案的估计。此外，该方法包括将获得的纯形式的物质的衍射图案与样品的衍射图案拟合，以确定每个样品中存在哪些物质。

3. 发明申请

WO2008035960A2 METHOD FOR THE PREPARATION OF A CO-CRYSTAL 审中-公开
标题翻译：制备共晶的方法
公开(公告)号：WO2008035960A2
公开(公告)日：2008-03-27
申请号：PCT/NL2007000226
申请日：2007-09-13
申请人： AVANTIUM INT BV , MCKAY BENJAMIN , RAS ERIK-JAN , MAZUREK JAROSLAW MAREK , CAINS PETER
发明人： MCKAY BENJAMIN , RAS ERIK-JAN , MAZUREK JAROSLAW MAREK , CAINS PETER
IPC分类号： G06F19/00 , G06F19/16
CPC分类号： G06F19/704 , G06F19/701
摘要： Method for the preparation of a co-crystal from an Active Pharmaceutical Ingredient (API) and a co-moiety by providing a molecular model representing at least a part of the physical and chemical properties of the API; providing a molecular model for each of a set of known co-moieties representing at least a part of the physical and chemical properties of each respective co-moiety; for each co-moiety in the set of step (b), determining whether at least one hydrogen-bond between the ACI molecule and the co-moiety is possible by comparing the molecular model of the ACI molecule as provided in step (a) and the molecular model of the co-moiety as provided in step (b); and excluding any co-moiety not capable of hydrogen-bonding with the ACI molecule, thereby obtaining a set of hydrogen-bonding co-moieties, selecting a suitable solvent and performing a set of experiments providing co-crystals of the API.
摘要翻译：通过提供代表API的物理和化学性质的至少一部分的分子模型，由活性药物成分（API）和共同部分制备共晶的方法; 为表示每个相应共部分的物理和化学性质的至少一部分的一组已知共部分中的每一个提供分子模型; 对于步骤（b）的组中的每个共部分，通过比较步骤（a）和步骤（a）中提供的ACI分子的分子模型，确定ACI分子和共部分之间的至少一个氢键是否可能步骤（b）中提供的共部分的分子模型; 并排除任何不能与ACI分子氢键结合的共部分，从而获得一组氢键部分，选择合适的溶剂并进行一系列提供API共晶的实验。

4. 发明申请

WO2007035087A1 SYSTEM AND METHOD FOR SOLBILITY CURVE AND METASTABLE ZONE DETERMINATION 审中-公开
标题翻译：用于溶解度曲线和可测量区域确定的系统和方法
公开(公告)号：WO2007035087A1
公开(公告)日：2007-03-29
申请号：PCT/NL2006/000466
申请日：2006-09-21
申请人： AVANTIUM INTERNATIONAL B.V. , BODENSTAFF, Emilio, René , STAM, Danny, Dirk, Pieter, Willem , McKAY, Benjamin , LAMKADMI, Mimoun
发明人： BODENSTAFF, Emilio, René , STAM, Danny, Dirk, Pieter, Willem , McKAY, Benjamin , LAMKADMI, Mimoun
IPC分类号： G01N25/14 , G01N25/06 , G01N21/53
CPC分类号： G01N21/51 , G01N33/15
摘要： A system for determining a solubility of a substance comprises a holder to hold a sample comprising an amount of the substance and an amount of the solvent system. The system further comprises a temperature conditioner to alter a temperature of the sample, an optical measurement device to measure an optical parameter of the sample and a control device to control at least the temperature conditioner and the optical measurement device. The control device may be programmed to alter the temperature of the sample by the temperature conditioner, measure the optical parameter of the sample by the optical measurement device, and determine the solubility of the substance from a change of the optical parameter of the sample as a function of the temperature.
摘要翻译：用于确定物质的溶解度的系统包括用于保持包含一定量物质和一定量的溶剂体系的样品的保持器。该系统还包括用于改变样品温度的温度调节器，用于测量样品的光学参数的光学测量装置和至少控制温度调节器和光学测量装置的控制装置。控制装置可以被编程为通过温度调节器改变样品的温度，通过光学测量装置测量样品的光学参数，并且从样品的光学参数的变化确定物质的溶解度为功能的温度。

5. 发明申请

WO2010056109A8 SAMPLE ANALYSIS APPARATUS AND A METHOD OF ANALYSING A SAMPLE 审中-公开
标题翻译：样本分析装置和分析样品的方法
公开(公告)号：WO2010056109A8
公开(公告)日：2010-07-22
申请号：PCT/NL2009000208
申请日：2009-11-02
申请人： AVANTIUM HOLDING B V , MCKAY BENJAMIN , BENTSCHAP KNOOK DIRK FRANCOIS , VAN BANNING STEPHAN OLIVIER , COETZEE ANITA
发明人： MCKAY BENJAMIN , BENTSCHAP KNOOK DIRK FRANCOIS , VAN BANNING STEPHAN OLIVIER , COETZEE ANITA
IPC分类号： G01N21/51 , G01N15/02 , G01N21/03 , G01N21/53 , G01N21/65 , G01N21/82
CPC分类号： G01N21/51 , G01N15/0227 , G01N21/0332 , G01N21/532 , G01N21/534 , G01N21/82 , G01N2021/651 , G01N2201/062 , G01N2201/063
摘要： The invention relates to a sample analysis apparatus. The apparatus comprises: a radiation system to irradiate the sample in a vial and an analyser with a camera to analyse the radiation received from the sample in the vial. The apparatus is provided with a holder to releasable hold the vial and with an optical path for the radiation system to irradiate the sample and for the camera to make images of the sample. The radiation system can be used for front lighting of the sample in the vial or for back lighting of the sample in the vial. The camera may be provided with a telecentric lens.
摘要翻译：本发明涉及一种样本分析装置。该装置包括：用于将样品照射在小瓶中的辐射系统和具有相机的分析器，以分析从小瓶中的样品接收的辐射。该设备设置有保持器以可释放地保持小瓶并且具有用于辐射系统的光路以照射样品并使照相机进行样品的图像。辐射系统可用于样品瓶中的样品前照灯或样品瓶中样品的背光照明。相机可以设置有远心透镜。

6. 发明申请

WO2008035960A3 METHOD FOR THE PREPARATION OF A CO-CRYSTAL 审中-公开
公开(公告)号：WO2008035960A3
公开(公告)日：2008-03-27
申请号：PCT/NL2007/000226
申请日：2007-09-13
申请人： AVANTIUM INTERNATIONAL B.V. , McKAY, Benjamin , RAS, Erik-Jan , MAZUREK, Jaroslaw, Marek , CAINS, Peter
发明人： McKAY, Benjamin , RAS, Erik-Jan , MAZUREK, Jaroslaw, Marek , CAINS, Peter
IPC分类号： G06F19/00
摘要： Method for the preparation of a co-crystal from an Active Pharmaceutical Ingredient (API) and a co-moiety by providing a molecular model representing at least a part of the physical and chemical properties of the API; providing a molecular model for each of a set of known co-moieties representing at least a part of the physical and chemical properties of each respective co-moiety; for each co-moiety in the set of step (b), determining whether at least one hydrogen-bond between the ACI molecule and the co-moiety is possible by comparing the molecular model of the ACI molecule as provided in step (a) and the molecular model of the co-moiety as provided in step (b); and excluding any co-moiety not capable of hydrogen-bonding with the ACI molecule, thereby obtaining a set of hydrogen-bonding co-moieties, selecting a suitable solvent and performing a set of experiments providing co-crystals of the API.

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