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Toutes les applications du développeur Kirill Blinov

Molecule

iOS Universel / Education

v1.4 Il y a 8 heures

Simple modern chemical structure editor. Allow to draw and share chemical structure. MF, MW, Monoisotopic Mass and Elemental Composition calculated interactively during drawing.

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m/z

iOS Universel / Productivité

v2.0 Il y a 1 an et demi

Find chemical structure by exact mass (m/z). Instant search in a database of known structures with exact mass less than 340 Da (about 35 million) created from PubChem compounds database.

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Orange NMR

macOS / Education

v2.4 Il y a 1 an et demi

App to predict 13C and 1H NMR spectra: draw a structure to see its spectrum. The accuracy of the algorithm is about 1.9 ppm for 13C and 0.21 ppm for 1H (RMSD=3.4 and 0.31 ppm correspondingly)....

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Orange NMR

iOS Universel / Education

v2.4 Il y a 1 an et demi

App to predict 13C and 1H NMR spectra: draw a structure to see its spectrum. The accuracy of the algorithm is about 1.9 ppm for 13C and 0.21 ppm for 1H (RMSD=3.4 and 0.31 ppm correspondingly)....

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Trivial Names

iOS Universel / Références

v1.1 Il y a 1 an et demi

Find organic compound by its name. Contains about 188K compounds from different sources. Most compounds have links to internet databases: PubChem, EPA CompTox, HMDB and ChEBI.

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CompTox Mobile

iOS Universel / Productivité

v1.0 Il y a 1 an et demi

Find chemical structure instantly by exact mass (m/z), ¹³C NMR chemical shifts, structure name or CAS Registry Number in a database of about 720,000 EPA CompTox structures. The Chemistry...

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Natural Products

iOS Universel / Productivité

v1.0 Il y a 1 an et demi

Find natural product by ¹³C NMR chemical shifts and monoisotopic mass (m/z of molecular ion). Instant search in a database of about 2.4 million natural products, natural product derivatives...

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m/z EPA CompTox

iOS Universel / Productivité

v1.0 Il y a 1 an et demi

Find chemical structure by exact mass (m/z) in EPA CompTox structures. Instant search in a database of more than 700,000 structures.

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Find Molecule

iOS Universel / Productivité

v1.0 Il y a 1 an et demi

Find chemical structure by ¹³C NMR chemical shifts and monoisotopic mass (m/z of molecular ion). Instant search in a database of about 33 million known structures extracted from PubChem...

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Molecular Formula Generator

iPhone / Education

v1.4 Il y a 1 an et demi

Generates full list of molecular formulae based on molecular mass (m/z value) and elemental composition. - Specify m/z value, mass accuracy, possible element composition and double bonds...

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