Atom Biology General Molecule Reaction Tools Trial Virus

<< < 1 2 3 4 5 6 7 8 9 … > >>   ∑:15912  Sort:Date

Molecule FYI-1002031
Molecule Summary: ID: FYI-1002031 Names: InChIKey: QARLNMDDSQMINK-BVRKHOPBSA-N SMILES: Cc4c(Nc2nccc3cc(CN1CC[C@@H](O) C1)cnc23)cccc4c8cccc(c7nc6cc(C N5CC[C@@H](C(=O)O)C5)cc(C#N)c6 o7)c8CReceived at FYIcenter.com on: 2023-01-19 2023-01-20, 3994🔥, 0💬

Ketcher JavaScript API
Where to find FAQ (Frequently Asked Questions) on Ketcher JavaScript API? Here is a list of tutorials to answer many frequently asked questions compiled by FYIcenter.com team on Ketcher JavaScript API. What Is Ketcher JavaScript API contentWindow.ketcher - Access "ketcher" Object ketcher.setMolecule... 2023-10-05, 3986🔥, 0💬

Molecule FYI-1004928
Molecule Summary: ID: FYI-1004928 Names: InChIKey: RKVAFXCYOQTGHV-HMIIVJTLSA-L SMILES: Cc8cc(C)nc(NS(=O)(=O)c7ccc([N+ ]2=Cc1cc(I)cc(I)c1O[Zn]24([OH2 +])([OH2+])Oc3c(I)cc(I)cc3C=[N +]4c6ccc(S(=O)(=O)Nc5nc(C)cc(C )n5)cc6)cc7)n8Received at FYIcenter.com on: 2023-10-01 2023-10-11, 3983🔥, 0💬

"babel" vs. "obabel" Commands
What are the differences between "babel" and "obabel" commands? "babel" and "obabel" commands are two commands of the same Open Babel chemical data conversion program with slightly different command line syntaxes. You can see the syntax differences between "babel" and "obabel" commands by running th... 2021-07-19, 3978🔥, 0💬

Enantiomers Isomer Example
What are examples of Enantiomers Isomers? The picture below gives an example of Enantiomers Isomers: Stereoisomers &gt; Enantiomers (Mirror Images) The molecule on the left is (R)-Lactic Acid with a chiral C in (R)-configuration, or right-hand configuration, or clockwise configuration. The molec... 2020-08-03, 3974🔥, 1💬

Molecule FYI-1003294
Molecule Summary: ID: FYI-1003294 Names: InChIKey: RLJQKMDDWVEIGY-UHFFFAOYSA-N SMILES: COc3cccc(c2ncc(c1ccccc1C)o2)c3 OCReceived at FYIcenter.com on: 2023-05-31 2023-06-19, 3947🔥, 0💬

Convert SDF to SVG using Open Babel
How to convert Convert SDF to SVG (Scalable Vector Graphics) using Open Babel? I want to see the molecule structure as a SVG file. If you want to see the molecule structure specified in a SDF file, you can convert it to a SVG (Scalable Vector Graphics) file using the "Open Babel" tool. 1. Download a... 2020-04-16, 3913🔥, 0💬

Molecule FYI-1001166
Molecule Summary: ID: FYI-1001166 SMILES: CCOc1ccc(CC2=NNC(=S)N2CC=C)cc1 Received at FYIcenter.com on: 2022-02-11 2022-07-01, 3907🔥, 0💬

Molecule FYI-1000217
Molecule Summary: ID: FYI-1000217 SMILES: C1[C@@H]2CC[C@@H]3[C@]([C@H]1O )(C2)CC[C@H]1[C@@]3(C)CCC[C@@] 1(C)C(=O)O;OC[C@H]1OC([C@H]2Oc 3ccccc3NC2=O)[C@@H]([C@H]([C@@ H]1O)O)OReceived at FYIcenter.com on: 2021-01-05 2021-08-04, 3889🔥, 1💬

Molecule FYI-1003941
Molecule Summary: ID: FYI-1003941 Names: InChIKey: XAVMZYKSKCKTOL-UHFFFAOYSA-N SMILES: CCOc3cccc(c2ccc1[nH]ccc1c2)c3 Received at FYIcenter.com on: 2023-08-07 2023-08-09, 3888🔥, 0💬

Molecule FYI-1003790
Molecule Summary: ID: FYI-1003790 Names: InChIKey: LNVYCXJCGCKELS-UHFFFAOYSA-N SMILES: C1COCOCOCOCOCOCOCOCOCOCOCOCOCO COCO1Received at FYIcenter.com on: 2023-07-26 2023-08-09, 3861🔥, 0💬

JSME Molecule Editor Options
What JSME Molecule Editor Options? JSME Molecule Editor Options are parameters that can be passed to the editor through the API to change it behavior. Here are the options supported by JSME: xbutton, noxbutton - show / hide the X button (default is xbutton) rbutton, norbutton - show / hide the R but... 2020-05-18, 3860🔥, 0💬

Simple Pharmacokinetics Script in Python
What Is the Simple Pharmacokinetics Script in Python? Simple Pharmacokinetics Script in Python is developed by Alex Dickson and available at https://github.com/alexrd/pk . Features supported are: can implement an arbitrary sequence of doses; can specify absorption, elimination, distribution and bind... 2023-12-21, 3859🔥, 1💬

💬 2023-12-21 Ronaldo: Trying Simple Pharmacokinetics Script on Python.

Molecule FYI-1003680
Molecule Summary: ID: FYI-1003680 Names: PENTANE; InChIKey: OFBQJSOFQDEBGM-UHFFFAOYSA-N SMILES: CCCCC Received at FYIcenter.com on: 2023-07-18 2023-07-29, 3845🔥, 0💬

Molecule FYI-1006479
Molecule Summary: ID: FYI-1006479 Names: InChIKey: VWYIWOYBERNXLX-MDZDMXLPSA-N SMILES: CCCCCCCC/C=C/CCCCCCCC(=O)OCC1C O1Received at FYIcenter.com on: 2023-12-27 2023-12-31, 3827🔥, 0💬

Molecule FYI-1002970
Molecule Summary: ID: FYI-1002970 Names: NICKEL, BIS(3,5-HEPTANEDIONATO-O,O''-2 ,2,6,6-TETRAMETHYL)-;InChIKey: PIIJAZNTPALBJL-ATMONBRVSA-L SMILES: CC(C)(C)C(=CC(=O)C(C)(C)C)[O-] .CC(C)(C)C(=CC(=O)C(C)(C)C)[O- ].[Ni+2]Received at FYIcenter.com on: 2023-05-03 2023-05-31, 3812🔥, 0💬

Molecule FYI-1004898
Molecule Summary: ID: FYI-1004898 Names: InChIKey: ITHUWDONTHSZRK-UHFFFAOYSA-K SMILES: C[Ru](Cl)(Cl)(Cl)(Cl)[n+]1cc[n H]c1.CS([CH2-])=O.[H+].c1c[nH] cn1Received at FYIcenter.com on: 2023-09-27 2023-10-11, 3790🔥, 0💬

Reaction FYI-1005060
Reaction Summary: ID: FYI-1005060 Formula: SMILES: Cl.[Na]O>>[Na]Cl.O Received at FYIcenter.com on: 2023-10-12 2023-10-12, 3783🔥, 0💬

"babel ... -f # -l #" - Split Large Molecule File
How to split a file with a large number of molecules? You can split a file with a large number of molecules into smaller files by extracting a chunk of molecules to the output using the "-f #" and "-l #" options. The "-f #" option specifies the index of the first molecule to be extracted. The "-l #"... 2020-09-30, 3777🔥, 0💬

Molecule FYI-1006056
Molecule Summary: ID: FYI-1006056 Names: InChIKey: LGICHARVPCWPQI-AIJKTPEZSA-Q SMILES: C[C@H]6CCC[N@@H+](Cc5cc4C(=O)[ NH+](c3cccc([C@@]2(C1NNC=[N+]1 C)C[C@H](C)C2)c3)Cc4c(C(F)(F)F )c5)C6Received at FYIcenter.com on: 2023-11-25 2023-12-01, 3770🔥, 0💬

Molecule FYI-1003453
Molecule Summary: ID: FYI-1003453 Names: InChIKey: NKPHEWJJTGPRSL-OCCSQVGLSA-N SMILES: CCC(=O)c3ccc(F)c([C@@H]1C[C@@H ]1NC(=O)Nc2ccc(C#N)cn2)c3OReceived at FYIcenter.com on: 2023-06-20 2023-07-08, 3751🔥, 0💬

What Is JSME JavaScript API
What is JSME JavaScript API? I want to see an example on how to use it. JSME JavaScript API is programming interface provided by JSME for your JavaScript code to interact with the JSME editor. JSME JavaScript API offers the following primary methods under the "JSApplet.JSME" class, which is provided... 2020-05-18, 3748🔥, 0💬

Stereoinformation in SDF/Mol V3000 Files
How Stereoinformation is stored in in SDF/Mol V3000 files? Similar to SDF/Mol V2000, stereoinformation can be stored in SDF/Mol V3000 files in 3 ways: 0D, 2D, and 3D. 0D: Stereoinformation in 0 dimension is defined by parity at atom lines as "CFG=n" options. 2D: Stereoinformation in 2 dimension is d... 2021-02-06, 3745🔥, 0💬

Molecule FYI-1003976
Molecule Summary: ID: FYI-1003976 Names: InChIKey: SOBPKJYDSKIMNI-UHFFFAOYSA-N SMILES: O=N(=O)c4ccc(CSc3nnc(c2ccc1ncc cc1c2)o3)cc4Received at FYIcenter.com on: 2023-08-08 2023-09-05, 3728🔥, 0💬

<< < 1 2 3 4 5 6 7 8 9 … > >>   ∑:15912  Sort:Date

Atom Biology General Molecule Reaction Tools Trial Virus