目前的計算機輔助藥物設(shè)計旨在公布基于計算技術(shù)的藥物設(shè)計的所有最新進展。計算機輔助藥物設(shè)計在藥物設(shè)計領(lǐng)域有著廣泛的影響。當前的計算機輔助藥物設(shè)計是所有希望了解和掌握計算機輔助方法及其在藥物發(fā)現(xiàn)中應(yīng)用的所有最新和重要進展的醫(yī)學(xué)化學(xué)家的重要期刊。每一期都包含一系列及時、深入的評論/小評論、原始研究文章和該領(lǐng)域領(lǐng)導(dǎo)撰寫的信函文章，涵蓋了藥物設(shè)計、篩選、ADME研究、理論化學(xué)、計算化學(xué)、計算機和分子圖形學(xué)、分子建模、蛋白質(zhì)工程等一系列計算技術(shù)。工程設(shè)計；藥物設(shè)計；專家系統(tǒng)；一般結(jié)構(gòu)-性質(zhì)關(guān)系；分子動力學(xué)；化學(xué)數(shù)據(jù)庫開發(fā)與使用等，為藥物開發(fā)提供了良好的理論依據(jù)。

Current Computer-Aided Drug Design aims to publish all the latest developments in drug design based on computational techniques. The field of computer-aided drug design has had extensive impact in the area of drug design.Current Computer-Aided Drug Design is an essential journal for all medicinal chemists who wish to be kept informed and up-to-date with all the latest and important developments in computer-aided methodologies and their applications in drug discovery. Each issue contains a series of timely, in-depth reviews/mini-reviews, original research articles and letter articles written by leaders in the field, covering a range of computational techniques for drug design, screening, ADME studies, theoretical chemistry; computational chemistry; computer and molecular graphics; molecular modeling; protein engineering; drug design; expert systems; general structure-property relationships; molecular dynamics; chemical database development and usage etc., providing excellent rationales for drug development.