Zobrazeno 1 - 4
of 4
pro vyhledávání: '"Nassirah Laloo"'
Publikováno v:
International Journal of Computer Applications. 176:1-7
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::2aed9f0b50bf580d5a788dda7a207e83
https://doi.org/10.5120/ijca2020920329
https://doi.org/10.5120/ijca2020920329
Publikováno v:
Journal of Computational Chemistry. 40:619-624
The distortion/interaction-activation strain model (D/I-ASM), a fragment analysis method, is applied to study the structure-reactivity relationship in reactions. The application of D/I-ASM involves the generation of input files for points along a rea
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::b815356f8d876a6620879a011625488e
https://doi.org/10.1002/jcc.25546
https://doi.org/10.1002/jcc.25546
Publikováno v:
International Journal of Computer Applications. 176:1-6
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::6eab8e327b70417985e58dc36d032405
https://doi.org/10.5120/ijca2017915530
https://doi.org/10.5120/ijca2017915530
Publikováno v:
Journal of computer-aided molecular design. 31(7)
The processing of the input and output files of quantum chemical calculations often necessitates a spreadsheet as a key component of the workflow. Spreadsheet packages with a built-in programming language editor can automate the steps involved and th
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::0d7219419d1cd53641c5e9d3103cdb09
https://pubmed.ncbi.nlm.nih.gov/28624971
https://pubmed.ncbi.nlm.nih.gov/28624971