OpenMM

Python wrapper for OpenMM (a C++ MD package)

Project description

OpenMM is a toolkit for molecular simulation. It can be used either as a: stand-alone application for running simulations, or as a library you call from your own code. It provides a combination of extreme flexibility (through custom forces and integrators), openness, and high performance (especially on recent GPUs) that make it truly unique among simulation codes.

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This version

8.1.1

May 10, 2024

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OpenMM-8.1.1-pp39-pypy39_pp73-manylinux_2_17_x86_64.manylinux2014_x86_64.whl (12.2 MB view hashes)

Uploaded May 10, 2024 PyPy manylinux: glibc 2.17+ x86-64

OpenMM-8.1.1-cp312-cp312-win_amd64.whl (10.6 MB view hashes)

Uploaded May 10, 2024 CPython 3.12 Windows x86-64

OpenMM-8.1.1-cp312-cp312-manylinux_2_17_x86_64.manylinux2014_x86_64.whl (12.2 MB view hashes)

Uploaded May 10, 2024 CPython 3.12 manylinux: glibc 2.17+ x86-64

OpenMM-8.1.1-cp312-cp312-macosx_11_0_arm64.whl (11.3 MB view hashes)

Uploaded May 10, 2024 CPython 3.12 macOS 11.0+ ARM64

OpenMM-8.1.1-cp312-cp312-macosx_10_9_x86_64.whl (11.8 MB view hashes)

Uploaded May 10, 2024 CPython 3.12 macOS 10.9+ x86-64

OpenMM-8.1.1-cp311-cp311-win_amd64.whl (10.6 MB view hashes)

Uploaded May 10, 2024 CPython 3.11 Windows x86-64

OpenMM-8.1.1-cp311-cp311-manylinux_2_17_x86_64.manylinux2014_x86_64.whl (12.2 MB view hashes)

Uploaded May 10, 2024 CPython 3.11 manylinux: glibc 2.17+ x86-64

OpenMM-8.1.1-cp311-cp311-macosx_11_0_arm64.whl (11.3 MB view hashes)

Uploaded May 10, 2024 CPython 3.11 macOS 11.0+ ARM64

OpenMM-8.1.1-cp311-cp311-macosx_10_9_x86_64.whl (11.8 MB view hashes)

Uploaded May 10, 2024 CPython 3.11 macOS 10.9+ x86-64

OpenMM-8.1.1-cp310-cp310-win_amd64.whl (10.6 MB view hashes)

Uploaded May 10, 2024 CPython 3.10 Windows x86-64

OpenMM-8.1.1-cp310-cp310-manylinux_2_17_x86_64.manylinux2014_x86_64.whl (12.2 MB view hashes)

Uploaded May 10, 2024 CPython 3.10 manylinux: glibc 2.17+ x86-64

OpenMM-8.1.1-cp310-cp310-macosx_11_0_arm64.whl (11.3 MB view hashes)

Uploaded May 10, 2024 CPython 3.10 macOS 11.0+ ARM64

OpenMM-8.1.1-cp310-cp310-macosx_10_9_x86_64.whl (11.8 MB view hashes)

Uploaded May 10, 2024 CPython 3.10 macOS 10.9+ x86-64

OpenMM-8.1.1-cp39-cp39-win_amd64.whl (10.6 MB view hashes)

Uploaded May 10, 2024 CPython 3.9 Windows x86-64

OpenMM-8.1.1-cp39-cp39-manylinux_2_17_x86_64.manylinux2014_x86_64.whl (12.2 MB view hashes)

Uploaded May 10, 2024 CPython 3.9 manylinux: glibc 2.17+ x86-64

OpenMM-8.1.1-cp39-cp39-macosx_11_0_arm64.whl (11.3 MB view hashes)

Uploaded May 10, 2024 CPython 3.9 macOS 11.0+ ARM64

OpenMM-8.1.1-cp39-cp39-macosx_10_9_x86_64.whl (11.8 MB view hashes)

Uploaded May 10, 2024 CPython 3.9 macOS 10.9+ x86-64

OpenMM-8.1.1-cp38-cp38-win_amd64.whl (10.6 MB view hashes)

Uploaded May 10, 2024 CPython 3.8 Windows x86-64

OpenMM-8.1.1-cp38-cp38-manylinux_2_17_x86_64.manylinux2014_x86_64.whl (12.2 MB view hashes)

Uploaded May 10, 2024 CPython 3.8 manylinux: glibc 2.17+ x86-64

OpenMM-8.1.1-cp38-cp38-macosx_11_0_arm64.whl (11.3 MB view hashes)

Uploaded May 10, 2024 CPython 3.8 macOS 11.0+ ARM64

OpenMM-8.1.1-cp38-cp38-macosx_10_9_x86_64.whl (11.8 MB view hashes)

Uploaded May 10, 2024 CPython 3.8 macOS 10.9+ x86-64

Hashes for OpenMM-8.1.1-pp39-pypy39_pp73-manylinux_2_17_x86_64.manylinux2014_x86_64.whl

Hashes for OpenMM-8.1.1-pp39-pypy39_pp73-manylinux_2_17_x86_64.manylinux2014_x86_64.whl
Algorithm	Hash digest
SHA256	`e0590cc86eb757156d44a0fadc31844e8973b25f491c0495a88fe16f76153208`
MD5	`79c08364ce0b885c91243fff9d2c3f28`
BLAKE2b-256	`591350da91164cf9c9656bf5b0890146c85f44e0ed1dabbbb9a167a37d2264b9`

Hashes for OpenMM-8.1.1-cp312-cp312-win_amd64.whl

Hashes for OpenMM-8.1.1-cp312-cp312-win_amd64.whl
Algorithm	Hash digest
SHA256	`31b037bbfe1e8e9919d8bb777c64ded0989c2c7a047d3b2c77a97d5ca86fe3c3`
MD5	`0b0200fb37b6806b8b58e3e689011308`
BLAKE2b-256	`0bf4b8495337bc9e3fa85b4b71a72cdb26f1da2ffa5391b73cd1e2b62736026b`

Hashes for OpenMM-8.1.1-cp312-cp312-manylinux_2_17_x86_64.manylinux2014_x86_64.whl

Hashes for OpenMM-8.1.1-cp312-cp312-manylinux_2_17_x86_64.manylinux2014_x86_64.whl
Algorithm	Hash digest
SHA256	`0b47ec2cfd0a06af675e4630cca352944b70a69f5700faa5b98d2bf10373371d`
MD5	`250a38040f3e7504dd9d4422b6298f4c`
BLAKE2b-256	`7626ad9aaccd9a7fead6469241963cf10f4d90ec681ebef639766ee645398c79`

Hashes for OpenMM-8.1.1-cp312-cp312-macosx_11_0_arm64.whl

Hashes for OpenMM-8.1.1-cp312-cp312-macosx_11_0_arm64.whl
Algorithm	Hash digest
SHA256	`3d7320a3ee296bfd9bdf5fbd02bc2009ed6e6dc0114e02843fde95dccba2da02`
MD5	`f4e7a43b70d095c8fa66566cc0956f72`
BLAKE2b-256	`adad3962183b0f8fe81969138157b1cfda030996dd65a6cdfb26d703141203ba`

Hashes for OpenMM-8.1.1-cp312-cp312-macosx_10_9_x86_64.whl

Hashes for OpenMM-8.1.1-cp312-cp312-macosx_10_9_x86_64.whl
Algorithm	Hash digest
SHA256	`b647d6cb12fcac0fd148cf09992bb02e3133a63b97b1b91cf0cf9b4f757212c7`
MD5	`4cbce1a32eef58050dfb0161716dc153`
BLAKE2b-256	`d3da7bb3c5db39e0311cf3034dba0e306fa0ee9db2ca4aee19cb818ebeb402f0`

Hashes for OpenMM-8.1.1-cp311-cp311-win_amd64.whl

Hashes for OpenMM-8.1.1-cp311-cp311-win_amd64.whl
Algorithm	Hash digest
SHA256	`6aa164ebd8a71600f7364f4a487929cf27f2bc6a1037c3bc08fbd1af3b86d385`
MD5	`897f4b7a05c879a3786f7d6e2a45bd03`
BLAKE2b-256	`7825177b3e6b85a26aa9170201dcba78a0dcc8a820307f007c9095db83ce40d7`

Hashes for OpenMM-8.1.1-cp311-cp311-manylinux_2_17_x86_64.manylinux2014_x86_64.whl

Hashes for OpenMM-8.1.1-cp311-cp311-manylinux_2_17_x86_64.manylinux2014_x86_64.whl
Algorithm	Hash digest
SHA256	`8481c211e2579ed1e2f0bc3be0289973ddbb61ba17fad2c83b5c0bdb14efe261`
MD5	`37ee38902d95ecea57aae79098e75836`
BLAKE2b-256	`1246d3133c1a72636493c4fdb8580f105c740decc856bb6072aab6093bb13623`

Hashes for OpenMM-8.1.1-cp311-cp311-macosx_11_0_arm64.whl

Hashes for OpenMM-8.1.1-cp311-cp311-macosx_11_0_arm64.whl
Algorithm	Hash digest
SHA256	`a34fb13ed41a09dbf12151d4aef81869e5c7fd15990d04e5451d515505f68155`
MD5	`cc0096599044b2fb2094342f3ee56be4`
BLAKE2b-256	`16192215920af65c09ecdad4ad18e7e70cc278ac66f12272675f99ffab076bac`

Hashes for OpenMM-8.1.1-cp311-cp311-macosx_10_9_x86_64.whl

Hashes for OpenMM-8.1.1-cp311-cp311-macosx_10_9_x86_64.whl
Algorithm	Hash digest
SHA256	`fd99105d5c8102e9272b7a458212f182b87e8bd852879e96bafa1544c27dbfd8`
MD5	`daa3781207f5aeea90f36c88ffd4d590`
BLAKE2b-256	`9a3fc98c2fe9a4a6d5286de4ccb19981ff3bd8880e710c59cc63e36f778dd253`

Hashes for OpenMM-8.1.1-cp310-cp310-win_amd64.whl

Hashes for OpenMM-8.1.1-cp310-cp310-win_amd64.whl
Algorithm	Hash digest
SHA256	`03d6d05e3b061e84632aadd477cae93cb9f1ebf78bfef8b5d523195fae726fff`
MD5	`12114a31ec005d056e7e4fca549e9a43`
BLAKE2b-256	`0b8bd85abf3ed866b0d470bae46cdabb04497d0205fd5b6a08f95f3976395863`

Hashes for OpenMM-8.1.1-cp310-cp310-manylinux_2_17_x86_64.manylinux2014_x86_64.whl

Hashes for OpenMM-8.1.1-cp310-cp310-manylinux_2_17_x86_64.manylinux2014_x86_64.whl
Algorithm	Hash digest
SHA256	`b84422387df2069cac2ba4403bec092d6ae08be3e47b110e0b60e27a28c9935c`
MD5	`4a4630ebc5879be7b33c46a729308f7d`
BLAKE2b-256	`d3f18b6d20260d53ded0734796d9f2395ba7464e48a4e4effb76c2c84ef871e0`

Hashes for OpenMM-8.1.1-cp310-cp310-macosx_11_0_arm64.whl

Hashes for OpenMM-8.1.1-cp310-cp310-macosx_11_0_arm64.whl
Algorithm	Hash digest
SHA256	`6d76bb0b00c194fdc8a8f46771096a007076ffd60f413600101bb962f2141f2b`
MD5	`1a5d9741f3bcf7ed677afd2b4c85c2e9`
BLAKE2b-256	`f1cbdf663c696ae097f340f19ea2b0342f3cfd7768e8be9cb8ac4ef9f4e7ae33`

Hashes for OpenMM-8.1.1-cp310-cp310-macosx_10_9_x86_64.whl

Hashes for OpenMM-8.1.1-cp310-cp310-macosx_10_9_x86_64.whl
Algorithm	Hash digest
SHA256	`38bab2ae16226a22b918ae0042d91f9f84c839beb711ce02fa9d6a1d71c851bd`
MD5	`9f6f248b87fc2b1b329a993cf93cf518`
BLAKE2b-256	`abeb66ec425112b4eef3e7fdb923c10f2ff12369ae049646d8871fae3ec43813`

Hashes for OpenMM-8.1.1-cp39-cp39-win_amd64.whl

Hashes for OpenMM-8.1.1-cp39-cp39-win_amd64.whl
Algorithm	Hash digest
SHA256	`651ec3d32693d552ebe552506c5ea54be64face6210f78ea77da62fa3c95cc19`
MD5	`0213d3e3fdaf7575f7bf896a19b5762a`
BLAKE2b-256	`a7199fae23938e1f1670b6d8017fde1ff2284c1fb019476b15d0651210abfd49`

Hashes for OpenMM-8.1.1-cp39-cp39-manylinux_2_17_x86_64.manylinux2014_x86_64.whl

Hashes for OpenMM-8.1.1-cp39-cp39-manylinux_2_17_x86_64.manylinux2014_x86_64.whl
Algorithm	Hash digest
SHA256	`27bcda6842e494364d06d610aa1bdd14151f04cbddabe85f2c07416f69d7e84f`
MD5	`c9cedfe430426e7a042988d471b8e46e`
BLAKE2b-256	`876dec636e72da2e20b4bef9b59bf8da098047d4a07bb39ee5c9059cbd2a87ad`

Hashes for OpenMM-8.1.1-cp39-cp39-macosx_11_0_arm64.whl

Hashes for OpenMM-8.1.1-cp39-cp39-macosx_11_0_arm64.whl
Algorithm	Hash digest
SHA256	`6bc3b1b02fe457bdc6623bddad361768e0b1d6b03196d6256f9ec9342554b854`
MD5	`95c72e92d5cb833654f0137970417d10`
BLAKE2b-256	`261a809bbb3817ea8b7bc47825379ffa00cca46598ffa008451dcedd92eae2f4`

Hashes for OpenMM-8.1.1-cp39-cp39-macosx_10_9_x86_64.whl

Hashes for OpenMM-8.1.1-cp39-cp39-macosx_10_9_x86_64.whl
Algorithm	Hash digest
SHA256	`f47e8d2ff02d872ee58e0eb96f4acbd5717bfc705991d01ae51e93462443c161`
MD5	`0e991d366fd841745db57db033100af2`
BLAKE2b-256	`78be48753d6c0dffe1cf084541baeffae55911e4f283200b85bf3764a073a6a1`

Hashes for OpenMM-8.1.1-cp38-cp38-win_amd64.whl

Hashes for OpenMM-8.1.1-cp38-cp38-win_amd64.whl
Algorithm	Hash digest
SHA256	`34bc73bdb25cef82cb138a8e3101167c841ebbed15d40ca50571a6ecd06fec7e`
MD5	`62e240ab6451b0afdba298eff2869091`
BLAKE2b-256	`855c8db4d42c79b622bd735106b3712208a7c28b0879d5ab2e4fbe3b278b6985`

Hashes for OpenMM-8.1.1-cp38-cp38-manylinux_2_17_x86_64.manylinux2014_x86_64.whl

Hashes for OpenMM-8.1.1-cp38-cp38-manylinux_2_17_x86_64.manylinux2014_x86_64.whl
Algorithm	Hash digest
SHA256	`2c98d7a0af479c293f209af2d5d7a78f287b2d38e750e388eef1654c3f134f50`
MD5	`3f0b28ae3178d5a75240fcd1959f5c7f`
BLAKE2b-256	`c29750fc9349469dd5525b68cf2f7fcd4cd0db19c611a6d67b7709c2c7fa2629`

Hashes for OpenMM-8.1.1-cp38-cp38-macosx_11_0_arm64.whl

Hashes for OpenMM-8.1.1-cp38-cp38-macosx_11_0_arm64.whl
Algorithm	Hash digest
SHA256	`e01deaa3764e7c65ca2310013fead182f162131cebcbb4d1731dac1eff50bf0a`
MD5	`84f8aa55b8b8746e12fa3899e400ec07`
BLAKE2b-256	`c3ff5098a484f230f362262e294d9df234cdc417bc7de05b7f44710a5e687fb4`

Hashes for OpenMM-8.1.1-cp38-cp38-macosx_10_9_x86_64.whl

Hashes for OpenMM-8.1.1-cp38-cp38-macosx_10_9_x86_64.whl
Algorithm	Hash digest
SHA256	`135cc745a2d98f56f4cefb672fd9cb6f4a5693879446efd84ec08e4ccf8d5a34`
MD5	`90448f641b738ef2966c6d46a8b82c17`
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