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SwissParam
SwissParam Diclofenac, Upload a Mol2 file (only 1 molecule, with all hydrogens and 3D coordinates) If the H atoms are not present, the parameterisation will possibly choose a...
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SwissParam
SwissParam Don't know where to start? Try with an example Diclofenac, Upload a Mol2 file (only 1 molecule, with all hydrogens and 3D coordinates) If the H atoms are...
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SwissParam
SwissParam Please, take our survey to find out how you use our tools and how we could improve them. It only takes 8 min. How to use SwissParam files for molecular dynamics simulations with G...
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SwissParam
Tutorials A video overview on: how to input a molecule how to select an approach for the parameterization how to start and monitor the running parameterization how to check the results
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SwissParam
SwissParam We hope SwissParam has been useful for your research. If so, please cite the following articles:
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SwissParam
Frequently Asked Questions 1. What is the main purpose of SwissParam? The main purpose of SwissParam is to provide user-friendly interface to create topology and parameters for small organic mo...