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Perspectives in drug discovery and design : PD3最新文献

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Calculating log P(oct) with no missing fragments; The problem of estimating new interaction parameters 计算无缺失片段的log P(oct);新交互参数的估计问题
Perspectives in drug discovery and design : PD3 Pub Date : 2000-06-01 DOI: 10.1023/A:1008739110753
A. Leo, D. Hoekman
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引用次数: 98
The hydrophobic fragmental constant approach forcalculating log P in octanol/water and aliphatic hydrocarbon/water systems 计算辛醇/水和脂肪烃/水体系logp的疏水片段常数方法
Perspectives in drug discovery and design : PD3 Pub Date : 2000-06-01 DOI: 10.1023/A:1008782809845
R. Mannhold, R. Rekker
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引用次数: 65
Combined molecular mechanical and continuum solvent approach (MM-PBSA/GBSA) to predict ligand binding 结合分子力学和连续溶剂方法(MM-PBSA/GBSA)预测配体结合
Perspectives in drug discovery and design : PD3 Pub Date : 2000-06-01 DOI: 10.1023/A:1008763014207
I. Massova, P. Kollman
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引用次数: 731
Observations on the strength of hydrogen bonding 氢键强度的观察
Perspectives in drug discovery and design : PD3 Pub Date : 2000-06-01 DOI: 10.1023/A:1008743229409
C. Laurence, M. Berthelot
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引用次数: 145
Hydrophobic and solvation effects on the solubility of hydroxysteroids in various solvents Quantitative and qualitative assessment by application of the mobile order and disorder theory 疏水和溶剂化对羟基类固醇在各种溶剂中的溶解度的影响应用流动有序和无序理论进行定量和定性评价
Perspectives in drug discovery and design : PD3 Pub Date : 2000-01-11 DOI: 10.1023/A:1008703513479
P. Ruelle, A. Farina-Cuendet, U. Kesselring
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引用次数: 14
Modeling liquid properties, solvation, and hydrophobicity: A molecular size-based perspective 模拟液体性质、溶剂化和疏水性:基于分子大小的视角
Perspectives in drug discovery and design : PD3 Pub Date : 2000-01-01 DOI: 10.1023/A:1008711420953
P. Buchwald
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引用次数: 13
The voltage-gated potassium channel: Sequence analysis and molecular modelling of the pore domain 电压门控钾通道:序列分析和孔隙域的分子模拟
Perspectives in drug discovery and design : PD3 Pub Date : 1999-07-12 DOI: 10.1023/A:1017024410293
I. Kerr, K. M. Ranatunga, M. Sansom
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引用次数: 0
The therapeutic potential for targetting potassium channels: Are dendrotoxins a suitable basis for drug design? 靶向钾通道的治疗潜力:树突毒素是药物设计的合适基础吗?
Perspectives in drug discovery and design : PD3 Pub Date : 1999-01-31 DOI: 10.1023/A:1017001231675
A. Harvey, M. Dufton
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引用次数: 2
Sea anemone toxins as templates for the design of immunosuppressant drugs 以海葵毒素为模板设计免疫抑制药物
Perspectives in drug discovery and design : PD3 Pub Date : 1999-01-01 DOI: 10.1023/A:1017071131670
W. Kem, M. Pennington, R. Norton
{"title":"Sea anemone toxins as templates for the design of immunosuppressant drugs","authors":"W. Kem, M. Pennington, R. Norton","doi":"10.1023/A:1017071131670","DOIUrl":"https://doi.org/10.1023/A:1017071131670","url":null,"abstract":"","PeriodicalId":92941,"journal":{"name":"Perspectives in drug discovery and design : PD3","volume":"15 1","pages":"111-129"},"PeriodicalIF":0.0,"publicationDate":"1999-01-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://sci-hub-pdf.com/10.1023/A:1017071131670","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"57089406","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 24
Molecular modeling of scorpion toxin binding to voltage-gated K+ channels 蝎子毒素与电压门控K+通道结合的分子模拟
Perspectives in drug discovery and design : PD3 Pub Date : 1999-01-01 DOI: 10.1023/A:1017097030766
G. Lipkind, H. Fozzard
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引用次数: 1
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