A general cross-platform text-based molecule builder for LAMMPS

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  • License: MIT License (MIT)
  • Author: Andrew Jewett
  • Tags simulation, LAMMPS, molecule editor, molecule builder, ESPResSo
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Project description

Moltemplate is a general cross-platform text-based molecule builder for LAMMPS and ESPResSo. Moltemplate was intended for building custom coarse-grained molecular models, but it can be used to prepare realistic all-atom simulations as well. It supports a variety of force fields for all-atom and coarse-grained modeling (including many-body forces and non-point-like particles). New force fields and examples are added continually by users. NOTE: Downloading moltemplate from pypi using PIP will omit all examples and documentation. Examples and documentation are available at https://moltemplate.org and https://github.com/jewettaij/moltemplate.

Project details

Verified details

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Avatar for jewettaij from gravatar.com jewettaij

Unverified details

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Project links
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  • License: MIT License (MIT)
  • Author: Andrew Jewett
  • Tags simulation, LAMMPS, molecule editor, molecule builder, ESPResSo
Classifiers

Release history Release notifications | RSS feed

2.20.20

2.20.19

2.20.18

2.20.17

2.20.15

2.20.14

2.20.13

2.20.12

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2.20.2

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2.20.0

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2.19.0

2.18.9

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2.18.6

2.18.5

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2.18.2

2.18.1

2.18.0

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2.16.5

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2.16.1

2.15.0

2.14.5

2.14.4

This version

2.14.2

2.14.1

2.13.1

2.13.0

2.12.12

2.12.11

2.12.10

2.12.9

2.12.8

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2.10.17

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2.5.7

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2.5.2

2.5.1

2.5.0

2.4.3

2.4.2

2.4.1

2.4.0

2.3.8

2.3.7

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