version = 4
[[package]]
name = "anstream"
version = "1.0.0"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "824a212faf96e9acacdbd09febd34438f8f711fb84e09a8916013cd7815ca28d"
dependencies = [
"anstyle",
"anstyle-parse",
"anstyle-query",
"anstyle-wincon",
"colorchoice",
"is_terminal_polyfill",
"utf8parse",
]
[[package]]
name = "anstyle"
version = "1.0.14"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "940b3a0ca603d1eade50a4846a2afffd5ef57a9feac2c0e2ec2e14f9ead76000"
[[package]]
name = "anstyle-parse"
version = "1.0.0"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "52ce7f38b242319f7cabaa6813055467063ecdc9d355bbb4ce0c68908cd8130e"
dependencies = [
"utf8parse",
]
[[package]]
name = "anstyle-query"
version = "1.1.5"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "40c48f72fd53cd289104fc64099abca73db4166ad86ea0b4341abe65af83dadc"
dependencies = [
"windows-sys",
]
[[package]]
name = "anstyle-wincon"
version = "3.0.11"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "291e6a250ff86cd4a820112fb8898808a366d8f9f58ce16d1f538353ad55747d"
dependencies = [
"anstyle",
"once_cell_polyfill",
"windows-sys",
]
[[package]]
name = "bumpalo"
version = "3.20.3"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "72f5acc6cb2ba439de613abc23857ec3d78374d8ed5ac84e9d11336e87da8649"
[[package]]
name = "cfg-if"
version = "1.0.4"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "9330f8b2ff13f34540b44e946ef35111825727b38d33286ef986142615121801"
[[package]]
name = "chematic-3d"
version = "1.0.32"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "3df5afa1de58a467246696dda4daa5c96cf0b32264fd977215066a5feecd9355"
dependencies = [
"chematic-chem",
"chematic-core",
"chematic-ff",
"chematic-fp",
"chematic-perception",
"chematic-smarts",
"serde_json",
"web-time",
]
[[package]]
name = "chematic-chem"
version = "1.0.32"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "fc1bbb827deb3440da97746980ffc1e6246fdff36d8fa8315efa0b194c37dd7c"
dependencies = [
"chematic-cip",
"chematic-core",
"chematic-fp",
"chematic-iupac",
"chematic-perception",
"chematic-smarts",
"chematic-smiles",
"rustc-hash",
"serde",
"serde_json",
]
[[package]]
name = "chematic-cip"
version = "1.0.32"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "18ab151b9bb9ecd79d1e9089dacb715f4dde316ddefdc289d253fd6276ab3215"
dependencies = [
"chematic-core",
"chematic-perception",
]
[[package]]
name = "chematic-cli"
version = "1.0.32"
dependencies = [
"chematic-chem",
"chematic-core",
"chematic-fp",
"chematic-mol",
"chematic-rxn",
"chematic-smarts",
"chematic-smiles",
"clap",
"serde_json",
]
[[package]]
name = "chematic-core"
version = "1.0.32"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "8df3222e6c9aca3ad11e6e5d7c4d440564a4e71ce202b089ac411b2332f7d852"
[[package]]
name = "chematic-ff"
version = "1.0.32"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "c858e9fdda375b7562c8ede230bb314f9368ac28fab135bde3fc7ce3a7eb779b"
dependencies = [
"chematic-core",
"chematic-perception",
"rayon",
]
[[package]]
name = "chematic-fp"
version = "1.0.32"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "6142b07deaf5f1cd9486dc081acdbf787668f2c7e5c2154d5da4c363f4f4a548"
dependencies = [
"chematic-cip",
"chematic-core",
"chematic-perception",
"chematic-rxn",
"chematic-smarts",
"chematic-smiles",
"rayon",
"rustc-hash",
"smallvec",
]
[[package]]
name = "chematic-iupac"
version = "1.0.32"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "3629676fe587886f9c9fc01f168d603a58d651e9ce748944c74776cfe6312ff2"
dependencies = [
"chematic-core",
"chematic-perception",
]
[[package]]
name = "chematic-mol"
version = "1.0.32"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "7b0daaacf2d9811d33a708509d44ce2501f7aafcd3e665bdb088f490213de3b0"
dependencies = [
"chematic-3d",
"chematic-core",
"chematic-perception",
"chematic-rxn",
"chematic-smiles",
"serde",
"serde_json",
]
[[package]]
name = "chematic-perception"
version = "1.0.32"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "7c11e2cef2b7235a8d56ca050d5ac95c5a0c491688b9e70108b51ed633205ff2"
dependencies = [
"chematic-core",
"rustc-hash",
]
[[package]]
name = "chematic-rxn"
version = "1.0.32"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "d920389fc6deb5405e0c228a6f804a1342dc5462df6656c81a875b36110e1273"
dependencies = [
"chematic-core",
"chematic-perception",
"chematic-smarts",
"chematic-smiles",
"rustc-hash",
"serde",
"serde_json",
]
[[package]]
name = "chematic-smarts"
version = "1.0.32"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "31b80cec5de0fe34c9d4ace2b274d9c2c4c750a27794390284a43c1f788f664e"
dependencies = [
"chematic-core",
"chematic-perception",
"rustc-hash",
"web-time",
]
[[package]]
name = "chematic-smiles"
version = "1.0.32"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "f904cd6df7a90aafd91e7f934701990b29989cf98d475c17432c2ac01c3c6610"
dependencies = [
"chematic-core",
"chematic-perception",
"smallvec",
]
[[package]]
name = "clap"
version = "4.6.7"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "aa8876b300ab35ba921adea3dfd70157a46249b33f95c9084ae5709785478946"
dependencies = [
"clap_builder",
"clap_derive",
]
[[package]]
name = "clap_builder"
version = "4.6.7"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "ec0797fb7aeb1406c84efac526901f7ec3ead2124f946b494e72879d4b54704d"
dependencies = [
"anstream",
"anstyle",
"clap_lex",
"strsim",
]
[[package]]
name = "clap_derive"
version = "4.6.7"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "f9c751b79415d4e559e3d1fcf128e09e720eb673a06d26cf6f392d37d75b66e0"
dependencies = [
"heck",
"proc-macro2",
"quote",
"syn 3.0.5",
]
[[package]]
name = "clap_lex"
version = "1.1.0"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "c8d4a3bb8b1e0c1050499d1815f5ab16d04f0959b233085fb31653fbfc9d98f9"
[[package]]
name = "colorchoice"
version = "1.0.5"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "1d07550c9036bf2ae0c684c4297d503f838287c83c53686d05370d0e139ae570"
[[package]]
name = "crossbeam-deque"
version = "0.8.8"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "622f3fc73690be383c7214310406f28a90e6edeadc3cea882f9d71e495b9711a"
dependencies = [
"crossbeam-epoch",
"crossbeam-utils",
]
[[package]]
name = "crossbeam-epoch"
version = "0.9.21"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "dc74980687109a3b14c72fd458107bf0baa1da1a1a805e178d15501ba9b86d9d"
dependencies = [
"crossbeam-utils",
]
[[package]]
name = "crossbeam-utils"
version = "0.8.23"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "a31eee39dddec8330830986fcd7625edb5a24ec90ea038215273bbc3adb08ac6"
[[package]]
name = "either"
version = "1.18.0"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "252afb9ae5eaa683babdc6a068b3f5726eb19e05070c731f9b2a23a7c3e8ed34"
[[package]]
name = "futures-core"
version = "0.3.34"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "92d699e522242e69e3003b94ecc1f960f3a5e015aa7c5d7486e65ad01dd94f5e"
[[package]]
name = "futures-task"
version = "0.3.34"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "cd417de3d1d015fc3bfd2b1ea46dfc7bab72ef86f1cc7cc9c78e728b34a6d1fd"
[[package]]
name = "futures-util"
version = "0.3.34"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "0d50a92467f8ba5dd6e3ee5d4bd04d73ab2e4e1c44474a0674821dfce14b79bc"
dependencies = [
"futures-core",
"futures-task",
"pin-project-lite",
"slab",
]
[[package]]
name = "heck"
version = "0.5.0"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "2304e00983f87ffb38b55b444b5e3b60a884b5d30c0fca7d82fe33449bbe55ea"
[[package]]
name = "is_terminal_polyfill"
version = "1.70.2"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "a6cb138bb79a146c1bd460005623e142ef0181e3d0219cb493e02f7d08a35695"
[[package]]
name = "itoa"
version = "1.0.18"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "8f42a60cbdf9a97f5d2305f08a87dc4e09308d1276d28c869c684d7777685682"
[[package]]
name = "js-sys"
version = "0.3.98"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "67df7112613f8bfd9150013a0314e196f4800d3201ae742489d999db2f979f08"
dependencies = [
"cfg-if",
"futures-util",
"once_cell",
"wasm-bindgen",
]
[[package]]
name = "memchr"
version = "2.8.3"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "cf8baf1c55e62ffcace7a9f06f4bd9cd3f0c4beb022d3b367256b91b87513d98"
[[package]]
name = "once_cell"
version = "1.21.4"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "9f7c3e4beb33f85d45ae3e3a1792185706c8e16d043238c593331cc7cd313b50"
[[package]]
name = "once_cell_polyfill"
version = "1.70.2"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "384b8ab6d37215f3c5301a95a4accb5d64aa607f1fcb26a11b5303878451b4fe"
[[package]]
name = "pin-project-lite"
version = "0.2.17"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "a89322df9ebe1c1578d689c92318e070967d1042b512afbe49518723f4e6d5cd"
[[package]]
name = "proc-macro2"
version = "1.0.107"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "985e7ec9bb745e6ce6535b544d84d6cd6f7ad8bd711c398938ae983b91a766d9"
dependencies = [
"unicode-ident",
]
[[package]]
name = "quote"
version = "1.0.47"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "1fbf4db142a473a8d80c26bbf18454ed458bf8d26c8219c331daecfdbd079001"
dependencies = [
"proc-macro2",
]
[[package]]
name = "rayon"
version = "1.12.0"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "fb39b166781f92d482534ef4b4b1b2568f42613b53e5b6c160e24cfbfa30926d"
dependencies = [
"either",
"rayon-core",
]
[[package]]
name = "rayon-core"
version = "1.13.0"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "22e18b0f0062d30d4230b2e85ff77fdfe4326feb054b9783a3460d8435c8ab91"
dependencies = [
"crossbeam-deque",
"crossbeam-utils",
]
[[package]]
name = "rustc-hash"
version = "2.1.3"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "6b1e7f9a428571be2dc5bc0505c13fb6bf936822b894ec87abf8a08a4e51742d"
[[package]]
name = "rustversion"
version = "1.0.23"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "cf54715a573b99ac80df0bc206da022bcd442c974952c7b9720069370852e21f"
[[package]]
name = "serde"
version = "1.0.229"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "4148590afebada386688f18773da617792bf2ef03ffc1e4cbd2b1d45b023e0ba"
dependencies = [
"serde_core",
"serde_derive",
]
[[package]]
name = "serde_core"
version = "1.0.229"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "67dca2c9c51e58a4791a4b1ed58308b39c64224d349a935ab5039aa360942a48"
dependencies = [
"serde_derive",
]
[[package]]
name = "serde_derive"
version = "1.0.229"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "e7a5d71263a5a7d47b41f6b3f06ba276f10cc18b0931f1799f710578e2309348"
dependencies = [
"proc-macro2",
"quote",
"syn 3.0.5",
]
[[package]]
name = "serde_json"
version = "1.0.151"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "c841b55ecdae098c80dcae9cf767f6f8a0c2cdb3416bbef72181df4d0fe73f14"
dependencies = [
"itoa",
"memchr",
"serde",
"serde_core",
"zmij",
]
[[package]]
name = "slab"
version = "0.4.12"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "0c790de23124f9ab44544d7ac05d60440adc586479ce501c1d6d7da3cd8c9cf5"
[[package]]
name = "smallvec"
version = "1.16.1"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "ba467056f1b547ed52077911161fc86985becbc60e8e1857c8a144dab0def891"
[[package]]
name = "strsim"
version = "0.11.1"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "7da8b5736845d9f2fcb837ea5d9e2628564b3b043a70948a3f0b778838c5fb4f"
[[package]]
name = "syn"
version = "2.0.119"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "872831b642d1a07999a962a351ed35b955ea2cfc8f3862091e2a240a84f17297"
dependencies = [
"proc-macro2",
"quote",
"unicode-ident",
]
[[package]]
name = "syn"
version = "3.0.5"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "12df2e0110f65b775f769bb17ef989067a1d931b2eb822bd4346631eeada89f9"
dependencies = [
"proc-macro2",
"quote",
"unicode-ident",
]
[[package]]
name = "unicode-ident"
version = "1.0.24"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "e6e4313cd5fcd3dad5cafa179702e2b244f760991f45397d14d4ebf38247da75"
[[package]]
name = "utf8parse"
version = "0.2.2"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "06abde3611657adf66d383f00b093d7faecc7fa57071cce2578660c9f1010821"
[[package]]
name = "wasm-bindgen"
version = "0.2.121"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "49ace1d07c165b0864824eee619580c4689389afa9dc9ed3a4c75040d82e6790"
dependencies = [
"cfg-if",
"once_cell",
"rustversion",
"wasm-bindgen-macro",
"wasm-bindgen-shared",
]
[[package]]
name = "wasm-bindgen-macro"
version = "0.2.121"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "8e68e6f4afd367a562002c05637acb8578ff2dea1943df76afb9e83d177c8578"
dependencies = [
"quote",
"wasm-bindgen-macro-support",
]
[[package]]
name = "wasm-bindgen-macro-support"
version = "0.2.121"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "d95a9ec35c64b2a7cb35d3fead40c4238d0940c86d107136999567a4703259f2"
dependencies = [
"bumpalo",
"proc-macro2",
"quote",
"syn 2.0.119",
"wasm-bindgen-shared",
]
[[package]]
name = "wasm-bindgen-shared"
version = "0.2.121"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "c4e0100b01e9f0d03189a92b96772a1fb998639d981193d7dbab487302513441"
dependencies = [
"unicode-ident",
]
[[package]]
name = "web-time"
version = "1.1.0"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "5a6580f308b1fad9207618087a65c04e7a10bc77e02c8e84e9b00dd4b12fa0bb"
dependencies = [
"js-sys",
"wasm-bindgen",
]
[[package]]
name = "windows-link"
version = "0.2.1"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "f0805222e57f7521d6a62e36fa9163bc891acd422f971defe97d64e70d0a4fe5"
[[package]]
name = "windows-sys"
version = "0.61.2"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "ae137229bcbd6cdf0f7b80a31df61766145077ddf49416a728b02cb3921ff3fc"
dependencies = [
"windows-link",
]
[[package]]
name = "zmij"
version = "1.0.23"
source = "registry+https://github.com/rust-lang/crates.io-index"
checksum = "29666d0abbfad1e3dc4dcf6144730dd3a3ab225bbbdac83319345b1b44ccfc1b"