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

2.20.10

2.20.9

2.20.8

2.20.7

2.20.6

2.20.5

2.20.3

2.20.2

2.20.1

2.20.0

2.19.14

2.19.13

2.19.12

2.19.11

2.19.10

2.19.9

2.19.8

2.19.7

2.19.6

2.19.5

2.19.4

2.19.3

2.19.2

2.19.1

2.19.0

2.18.9

2.18.8

2.18.7

2.18.6

2.18.5

2.18.4

2.18.3

This version

2.18.2

2.18.1

2.18.0

2.17.10

2.17.8

2.17.7

2.17.6

2.17.5

2.17.4

2.17.3

2.17.2

2.17.1

2.17.0

2.16.5

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2.16.3

2.16.2

2.16.1

2.15.0

2.14.5

2.14.4

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

2.12.7

2.12.6

2.12.5

2.12.4

2.12.3

2.12.2

2.12.1

2.12.0

2.11.3

2.11.2

2.11.0

2.10.17

2.10.16

2.10.15

2.10.14

2.10.13

2.10.12

2.10.11

2.10.10

2.10.9

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2.8.7

2.8.6

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2.8.4

2.8.3

2.8.2

2.8.1

2.8.0

2.7.4

2.7.3

2.7.1

2.7.0

2.6.0

2.5.7

2.5.5

2.5.3

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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