Toward the accurate prediction of P450-mediated metabolism and adverse drug reactions using novel MM methods and QM-derived rules
使用新型 MM 方法和 QM 衍生规则准确预测 P450 介导的代谢和药物不良反应
基本信息
- 批准号:441810-2012
- 负责人:
- 金额:$ 2.91万
- 依托单位:
- 依托单位国家:加拿大
- 项目类别:Collaborative Research and Development Grants
- 财政年份:2013
- 资助国家:加拿大
- 起止时间:2013-01-01 至 2014-12-31
- 项目状态:已结题
- 来源:
- 关键词:
项目摘要
Despite the large investment in toxicology and clinical trials of drug candidates, toxicity of drugs
尽管在毒理学和候选药物的临床试验上投入了大量资金,但药物的毒性
项目成果
期刊论文数量(0)
专著数量(0)
科研奖励数量(0)
会议论文数量(0)
专利数量(0)
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Moitessier, Nicolas其他文献
Constrained Peptidomimetics Reveal Detailed Geometric Requirements of Covalent Prolyl Oligopeptidase Inhibitors
- DOI:
10.1021/jm901013a - 发表时间:
2009-11-12 - 期刊:
- 影响因子:7.3
- 作者:
Lawandi, Janice;Toumieux, Sylvestre;Moitessier, Nicolas - 通讯作者:
Moitessier, Nicolas
Development of a Computational Tool to Rival Experts in the Prediction of Sites of Metabolism of Xenobiotics by P450s
- DOI:
10.1021/ci3003073 - 发表时间:
2012-09-01 - 期刊:
- 影响因子:5.6
- 作者:
Campagna-Slater, Valerie;Pottel, Joshua;Moitessier, Nicolas - 通讯作者:
Moitessier, Nicolas
A naturally occurring G11S mutation in the 3C-like protease from the SARS-CoV-2 virus dramatically weakens the dimer interface.
- DOI:
10.1002/pro.4857 - 发表时间:
2024-01 - 期刊:
- 影响因子:8
- 作者:
Wang, Guanyu;Venegas, Felipe A.;Rueda, Andres M.;Weerasinghe, Nuwani W.;Uggowitzer, Kevin A.;Thibodeaux, Christopher J.;Moitessier, Nicolas;Mittermaier, Anthony K. - 通讯作者:
Mittermaier, Anthony K.
3-Oxo-hexahydro-1H-isoindole-4-carboxylic Acid as a Drug Chiral Bicyclic Scaffold: Structure-Based Design and Preparation of Conformationally Constrained Covalent and Noncovalent Prolyl Oligopeptidase Inhibitors
- DOI:
10.1021/acs.jmedchem.5b01296 - 发表时间:
2016-05-12 - 期刊:
- 影响因子:7.3
- 作者:
Mariaule, Gaelle;De Cesco, Stephane;Moitessier, Nicolas - 通讯作者:
Moitessier, Nicolas
Directing/protecting groups mediate highly regioselective glycosylation of monoprotected acceptors
- DOI:
10.1016/j.tet.2011.07.026 - 发表时间:
2011-10-28 - 期刊:
- 影响因子:2.1
- 作者:
Lawandi, Janice;Rocheleau, Sylvain;Moitessier, Nicolas - 通讯作者:
Moitessier, Nicolas
Moitessier, Nicolas的其他文献
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{{ truncateString('Moitessier, Nicolas', 18)}}的其他基金
Integrating innovative computational and organic synthesis for efficient asymmetric catalyst discovery
整合创新计算和有机合成以实现高效的不对称催化剂发现
- 批准号:
RGPIN-2022-03383 - 财政年份:2022
- 资助金额:
$ 2.91万 - 项目类别:
Discovery Grants Program - Individual
Integrating organic chemistry and computational chemistry for efficient molecular discovery
整合有机化学和计算化学以实现高效的分子发现
- 批准号:
RGPIN-2016-04566 - 财政年份:2021
- 资助金额:
$ 2.91万 - 项目类别:
Discovery Grants Program - Individual
Integrating organic chemistry and computational chemistry for efficient molecular discovery
整合有机化学和计算化学以实现高效的分子发现
- 批准号:
RGPIN-2016-04566 - 财政年份:2020
- 资助金额:
$ 2.91万 - 项目类别:
Discovery Grants Program - Individual
Development of Efficient Molecular Mechanics Methods for Application in Drug Discovery and Design.
开发用于药物发现和设计的有效分子力学方法。
- 批准号:
550083-2020 - 财政年份:2020
- 资助金额:
$ 2.91万 - 项目类别:
Alliance Grants
Integrating organic chemistry and computational chemistry for efficient molecular discovery
整合有机化学和计算化学以实现高效的分子发现
- 批准号:
RGPIN-2016-04566 - 财政年份:2019
- 资助金额:
$ 2.91万 - 项目类别:
Discovery Grants Program - Individual
Integrating organic chemistry and computational chemistry for efficient molecular discovery
整合有机化学和计算化学以实现高效的分子发现
- 批准号:
RGPIN-2016-04566 - 财政年份:2018
- 资助金额:
$ 2.91万 - 项目类别:
Discovery Grants Program - Individual
Toward the accurate prediction of adverse drug reactions and drug-drug interactions using novel MM methods and QM-derived rules
使用新型 MM 方法和 QM 衍生规则准确预测药物不良反应和药物相互作用
- 批准号:
505509-2016 - 财政年份:2017
- 资助金额:
$ 2.91万 - 项目类别:
Collaborative Research and Development Grants
Integrating organic chemistry and computational chemistry for efficient molecular discovery
整合有机化学和计算化学以实现高效的分子发现
- 批准号:
RGPIN-2016-04566 - 财政年份:2017
- 资助金额:
$ 2.91万 - 项目类别:
Discovery Grants Program - Individual
Integrating organic chemistry and computational chemistry for efficient molecular discovery
整合有机化学和计算化学以实现高效的分子发现
- 批准号:
RGPIN-2016-04566 - 财政年份:2016
- 资助金额:
$ 2.91万 - 项目类别:
Discovery Grants Program - Individual
Toward the accurate prediction of P450-mediated metabolism and adverse drug reactions using novel MM methods and QM-derived rules.
使用新的 MM 方法和 QM 衍生规则准确预测 P450 介导的代谢和药物不良反应。
- 批准号:
469677-2014 - 财政年份:2015
- 资助金额:
$ 2.91万 - 项目类别:
Collaborative Research and Development Grants
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