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macromodel
https://www-jmg.ch.cam.ac.uk/cil/mmod.html18 Jul 2024: If two people draw cyclohexane and minimise it, one might get a chair conformation and the other a twist boat. -
Calculation of DP4
https://www-jmg.ch.cam.ac.uk/tools/nmr/DP4/15 Jul 2024: the goodman group. university of cambridge. Assignment of stereochemistry and structure using NMR and DP4. DP4-AI Automated NMR Data Analysis: Straight from Spectrometer to Structure. A. Howarth, K. Ermanis and J. M. Goodman. Chemical Science 2020, -
Eadfrith
https://www-jmg.ch.cam.ac.uk/software/eadfrith.html18 Jul 2024: university of cambridge. Eadfrith. The molecular display program Eadfrith is available for downloading from this page. Eadfrith is described in: J. Mol. Graph. 1996, 14, 59-61. J. M. Goodman. Please cite this reference if you use the program. -
Thiourea catalysis
https://www-jmg.ch.cam.ac.uk/publications/b817283h.html18 Jul 2024: university of cambridge. Thiourea catalysis. What is the mechanism of amine conjugate additions to pyrazole crotonate catalyzed by thiourea catalysts? L. Simon and J. M. Goodman, Org. Biomol. Chem. 2009, 7, 483-487. Related work on proton-transfer -
tools
https://www-jmg.ch.cam.ac.uk/tools.html26 Jul 2024: university of cambridge. tools. Software developed in the Goodman Research Group is available in this directory. This program combines. into a single executable, and adds many extra commands. Acca Documentation is available. CP3 - NMR comparison -
chemistry in the rest of the world
https://www-jmg.ch.cam.ac.uk/data/c2k/world.html18 Jul 2024: university of cambridge. chemistry in the rest of the world. c2k - Chemistry in the Rest of the World. The Rest of the World. This index and the programs used to maintain it are developed in the Goodman Group. All links checked: October 2019. The -
Consecutive reactions
https://www-jmg.ch.cam.ac.uk/tools/magnus/kinetic.html18 Jul 2024: university of cambridge. Consecutive reactions. Consecutive first step reversible reactions. A turns into B, with rate constant k. 1. , which turns into C, with rate constant k. 2. Now, B can turn back into A, with rate constant k. -1. Sorry, your -
utilities
https://www-jmg.ch.cam.ac.uk/cil/utilities.html18 Jul 2024: batq. List all jobs on the batch queues, including those submitted by other people (note. -
ACCA
https://www-jmg.ch.cam.ac.uk/software/acca.html18 Jul 2024: university of cambridge. ACCA. This program combines. into a single executable, and adds many extra commands. Descriptions of some parts of Acca have been published:. J. Chem. Soc. Perkin II (1997) A. Bueno Saz and J. M. Goodman, 1201-1204. J. Chem. -
Ring-Opening Polymerization
https://www-jmg.ch.cam.ac.uk/publications/jo702088c.html18 Jul 2024: university of cambridge. Ring-Opening Polymerization. The Mechanism of TBD-Catalyzed Ring-Opening Polymerization of Cyclic Esters. L. Simon and J. M. Goodman J. Org. Chem. 2007, 72, 9656-9662. We show that the proton-transfer process, Mechanism B -
Search
https://www-jmg.ch.cam.ac.uk/search.html26 Jul 2024: university of cambridge. search. the chemistry department webservers. Search. the Goodman Group webserver. Search. the index of chemistry departments worldwide. Search. publications from the Cambridge chemistry department. Search. the Cambridge -
Solubility Challenge
https://www-jmg.ch.cam.ac.uk/data/solubility/18 Jul 2024: university of cambridge. Solubility Challenge. Can You Predict Solubilities of Thirty-Two Molecules Using a Database of One Hundred Reliable Measurements? J. Chem. Inf. Modeling 2008, 48, 1289-1303. DOI: 10.1021/ci800058v. Antonio LlinĂ s, Robert C. -
Kinetic Resolution Calculation
https://www-jmg.ch.cam.ac.uk/tools/magnus/KinRes.html18 Jul 2024: university of cambridge. Kinetic Resolution Calculation. Kinetic Resolution Calculation. Sorry, your web browser does not support java. The equations used by this applet were developed by H B Kagan. References are given in the paper: J M Goodman, -
jaguar
https://www-jmg.ch.cam.ac.uk/cil/jaguar.html18 Jul 2024: university of cambridge. jaguar. Jaguar may be used as an independent program, but it is easiest to set up calculations using the Maestro interface. Documentation as PDF files in the directory: /usr/glea/schrodinger/docs/jaguar4/pdf/. Helpful -
Conjugate Alkenylation of Enones
https://www-jmg.ch.cam.ac.uk/publications/jo8007463.html18 Jul 2024: university of cambridge. Conjugate Alkenylation of Enones. Theoretical Study of the Asymmetric Conjugate Alkenylation of Enones Catalyzed by Binaphthols. R. S. Paton, J. M. Goodman and S. C. Pellegrinet J. Org. Chem. 2008, 73, 5078-5089. DOI: 10.1021 -
Solutions to Kinetic Equations
https://www-jmg.ch.cam.ac.uk/software/kin_demo.html18 Jul 2024: university of cambridge. Solutions to Kinetic Equations. A detailed description of these programs has been submitted for publication:. J. Chem. Ed. (1999) 76, 275-277. Goodman Group, 2005-2024; privacy; last updated July 18, 2024. -
Chemical History
https://www-jmg.ch.cam.ac.uk/history.html26 Jul 2024: university of cambridge. chemical history. Today in Chemical History: Saturday, July 27th, 2024. Born on this day, 1881. Nobel Prize in Chemistry, 1930 "for his researches into the constitution of haemin and chlorophyll and especially for his -
molecules
https://www-jmg.ch.cam.ac.uk/data/molecules/18 Jul 2024: university of cambridge. molecules. index of:. Notes. Interactive molecules using Jmol. SMILES strings from ChemDraw Pro. Canonical SMILES fromfrom cInChI version 1. MInChI is an experiment. Goodman Group, 2005-2024; privacy; last updated July 18, -
maestro - building molecules
https://www-jmg.ch.cam.ac.uk/cil/build.html18 Jul 2024: university of cambridge. maestro - building molecules. Maestro - Building Molecules. The Build panel for Maestro (Menu:. Project->Build. ) starts with the Fragments option displayed. Clicking on any of the fragments in the list and then clicking in -
Isomer Count
https://www-jmg.ch.cam.ac.uk/tools/isomercount/18 Jul 2024: university of cambridge. Exploration of the Accessible Chemical Space of Acyclic Alkanes. A problem that has long interested chemists has been to calculate the number of isomers for an alkane of any given carbon content. Whilst there appears to be
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