Making Sense the Ideas In Silico




Lab-in-Silico, Computational, Calculation, In silico, Idea


Improvements of computers hardware and software equipments have led to friendly using of these complicated systems especially in two last decades. Moreover, several types of mathematical algorithms, physical theories and chemical and biochemical concepts have been included in the computer systems. According to definition by Merriam-Webster, computer is “a programmable usually electronic device that can store, retrieve, and process data”. Therefore, if somebody wants to imagine by programing her/his mind, She/He could also do such parallel programming in the computer systems.


Merriam-Webster Dictionary.

Mirzaei M. Science and engineering in silico. Adv J Sci Eng. 2020;1:1-2.

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Harismah K, Ozkendir OM, Mirzaei M. Lithium adsorption at the C20 fullerene-like cage: DFT approach. Adv J Sci Eng. 2020;1:74-79.

Ozkendir OM. Electronic structure study of Sn-substituted InP semiconductor. Adv J Sci Eng. 2020;1:7-11.

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Nouri A, Mirzaei M. DFT calculations of B-11 and N-15 NMR parameters in BN nanocone. J Mol Struct THEOCHEM. 2009;913:207-209.

Partovi T, Mirzaei M, Hadipour NL. The C–H•••O hydrogen bonding effects on the 17O electric field gradient and chemical shielding tensors in crystalline 1-methyluracil: A DFT study. Z Naturforsch A. 2006;61:383-388.

Mirzaei M. The NMR parameters of the SiC-doped BN nanotubes: a DFT study. Physica E. 2010;42:1954-1957.

Soleimani M, Mirzaei M. In silico pharmacy: from computations to clinics. J Pharm Care. 2017;5:1.

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Merriam-Webster Dictionary.

Faramarzi R, Falahati M, Mirzaei M. Interactions of fluorouracil by CNT and BNNT: DFT analyses. Adv J Sci Eng. 2020;1:62-66.

Mirzaei M, Harismah K, Da'i M, Salarrezaei E, Roshandel Z. Screening efficacy of available HIV protease inhibitors on COVID-19 protease. J Mil Med. 2020;22:100-107.

Yaghoobi R, Mirzaei M. Computational analyses of cytidine and aza-cytidine molecular structures. Lab-in-Silico. 2020;1:21-26.

Tahmasebi E, Shakerzadeh E. Potential application of B40 fullerene as an innovative anode material for Ca-ion batteries: In silico investigation. Lab-in-Silico. 2020;1:16-20.




How to Cite

Mirzaei, M. (2020). Making Sense the Ideas In Silico. Lab-in-Silico, 1(2), 31–32.