Seventh Asia-Pacific Conference of Theoretical and Computational Chemistry (APCTCC7)

Yu, Chin‐Hui; Radom, Leo; Wong, Ming Wah

doi:10.1071/chv69n9_fo

Cited by 1 publication

(1 citation statement)

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“…One association that encourages the advancement of theoretical and computational chemistry in the Asian Pacific is the Asia-Pacific Association of Theoretical and Computational Chemists (APATCC), which was established in 2004. 12 This association organized a series of conferences called international conferences in theoretical and computational chemistry that were held in Okazaki, Japan (2004), Bangkok, Thailand (2005), Beijing, PR China (2007), Port Dickson, Malaysia (2009), Rotorua, New Zealand (2011), Gyeongju, Korea (2013), Kaohsiung, Taiwan (2016), and Mumbai, India (2017), and the latest conference was in Sydney, Australia in 2019. 13 APATCC conferences cover all aspects of computational and theoretical chemistry.…”

Section: ■ Introductionmentioning

confidence: 99%

A Decade of Indonesian Atmosphere in Computer-Aided Drug Design

Hariono

Wijaya

Frederick

et al. 2021

J. Chem. Inf. Model.

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The era of drug design aided by computers has been very welcome to Indonesian researchers working on drug discovery and its related fields. The availability of software, bioinformatics, and cheminformatics data that are free and friendly to use increases the interest in carrying the software, bioinformatics, and cheminformatics out in drug discovery projects. The computational method is believed to speed up the discovery of new drugs, because the computational method can predict the molecular behavior of chemical compounds to interact with biological systems. Therefore, the real experimental study cost should be minimized, since there are a few promising molecules for a drug in silico only that would be investigated further. This article describes a decade of research concerning drug design and discovery aided by computers in Indonesia from 2011 to 2020. A number of computer-aided drug design-related articles (CADDs) from Indonesian journals were collected during the decade, and their trend was analyzed. The results show that there was an increasing trend in the use of CADD programs by Indonesian researchers during those ten years. The most common methods being used were docking and molecular dynamics with AutoDock/AutoDock Vina and AMBER/GROMACS, respectively. In addition, the most common protein targets, ligand structures, and disease targets being studied were human estrogen receptor alpha (HERa), flavonoids, and cancer.

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Section: ■ Introductionmentioning

confidence: 99%