[INFO] fetching crate ffcharge 0.2.1...
[INFO] testing ffcharge-0.2.1 against master#562dee4820c458d823175268e41601d4c060588a for pr-154210-1
[INFO] extracting crate ffcharge 0.2.1 into /workspace/builds/worker-1-tc1/source
[INFO] started tweaking crates.io crate ffcharge 0.2.1
[INFO] removed 0 missing tests
[INFO] finished tweaking crates.io crate ffcharge 0.2.1
[INFO] tweaked toml for crates.io crate ffcharge 0.2.1 written to /workspace/builds/worker-1-tc1/source/Cargo.toml
[INFO] validating manifest of crates.io crate ffcharge 0.2.1 on toolchain 562dee4820c458d823175268e41601d4c060588a
[INFO] running `Command { std: CARGO_HOME="/workspace/cargo-home" RUSTUP_HOME="/workspace/rustup-home" "/workspace/cargo-home/bin/cargo" "+562dee4820c458d823175268e41601d4c060588a" "metadata" "--manifest-path" "Cargo.toml" "--no-deps", kill_on_drop: false }`
[INFO] crate crates.io crate ffcharge 0.2.1 already has a lockfile, it will not be regenerated
[INFO] running `Command { std: CARGO_HOME="/workspace/cargo-home" RUSTUP_HOME="/workspace/rustup-home" "/workspace/cargo-home/bin/cargo" "+562dee4820c458d823175268e41601d4c060588a" "fetch" "--manifest-path" "Cargo.toml", kill_on_drop: false }`
[INFO] running `Command { std: "docker" "create" "-v" "/var/lib/crater-agent-workspace/builds/worker-1-tc1/target:/opt/rustwide/target:rw,Z" "-v" "/var/lib/crater-agent-workspace/builds/worker-1-tc1/source:/opt/rustwide/workdir:ro,Z" "-v" "/var/lib/crater-agent-workspace/cargo-home:/opt/rustwide/cargo-home:ro,Z" "-v" "/var/lib/crater-agent-workspace/rustup-home:/opt/rustwide/rustup-home:ro,Z" "-e" "SOURCE_DIR=/opt/rustwide/workdir" "-e" "CARGO_TARGET_DIR=/opt/rustwide/target" "-e" "CARGO_HOME=/opt/rustwide/cargo-home" "-e" "RUSTUP_HOME=/opt/rustwide/rustup-home" "-w" "/opt/rustwide/workdir" "-m" "1610612736" "--user" "0:0" "--network" "none" "ghcr.io/rust-lang/crates-build-env/linux@sha256:d429b63d4308055ea97f60fb1d3dfca48854a00942f1bd2ad806beaf015945ec" "/opt/rustwide/cargo-home/bin/cargo" "+562dee4820c458d823175268e41601d4c060588a" "metadata" "--no-deps" "--format-version=1", kill_on_drop: false }`
[INFO] [stdout] 04000ea05370bc984d6fb8fcce1bbaeecc6e81c20962c316d81039f2820fe94c
[INFO] running `Command { std: "docker" "start" "-a" "04000ea05370bc984d6fb8fcce1bbaeecc6e81c20962c316d81039f2820fe94c", kill_on_drop: false }`
[INFO] running `Command { std: "docker" "inspect" "04000ea05370bc984d6fb8fcce1bbaeecc6e81c20962c316d81039f2820fe94c", kill_on_drop: false }`
[INFO] running `Command { std: "docker" "rm" "-f" "04000ea05370bc984d6fb8fcce1bbaeecc6e81c20962c316d81039f2820fe94c", kill_on_drop: false }`
[INFO] [stdout] 04000ea05370bc984d6fb8fcce1bbaeecc6e81c20962c316d81039f2820fe94c
[INFO] running `Command { std: "docker" "create" "-v" "/var/lib/crater-agent-workspace/builds/worker-1-tc1/target:/opt/rustwide/target:rw,Z" "-v" "/var/lib/crater-agent-workspace/builds/worker-1-tc1/source:/opt/rustwide/workdir:ro,Z" "-v" "/var/lib/crater-agent-workspace/cargo-home:/opt/rustwide/cargo-home:ro,Z" "-v" "/var/lib/crater-agent-workspace/rustup-home:/opt/rustwide/rustup-home:ro,Z" "-e" "SOURCE_DIR=/opt/rustwide/workdir" "-e" "CARGO_TARGET_DIR=/opt/rustwide/target" "-e" "CARGO_INCREMENTAL=0" "-e" "RUST_BACKTRACE=full" "-e" "RUSTFLAGS=--cap-lints=forbid" "-e" "RUSTDOCFLAGS=--cap-lints=forbid" "-e" "CARGO_HOME=/opt/rustwide/cargo-home" "-e" "RUSTUP_HOME=/opt/rustwide/rustup-home" "-w" "/opt/rustwide/workdir" "-m" "1610612736" "--user" "0:0" "--network" "none" "ghcr.io/rust-lang/crates-build-env/linux@sha256:d429b63d4308055ea97f60fb1d3dfca48854a00942f1bd2ad806beaf015945ec" "/opt/rustwide/cargo-home/bin/cargo" "+562dee4820c458d823175268e41601d4c060588a" "build" "--frozen" "--message-format=json", kill_on_drop: false }`
[INFO] [stdout] 1d511dae7aea74825a515e2fd72711be9db3a5b8e66f36b6f6cd48f89c2d4950
[INFO] running `Command { std: "docker" "start" "-a" "1d511dae7aea74825a515e2fd72711be9db3a5b8e66f36b6f6cd48f89c2d4950", kill_on_drop: false }`
[INFO] [stderr]    Compiling proc-macro2 v1.0.106
[INFO] [stderr]    Compiling siphasher v1.0.2
[INFO] [stderr]    Compiling quote v1.0.44
[INFO] [stderr]    Compiling serde_core v1.0.228
[INFO] [stderr]    Compiling memchr v2.8.0
[INFO] [stderr]    Compiling fastrand v2.3.0
[INFO] [stderr]    Compiling itoa v1.0.17
[INFO] [stderr]    Compiling ryu v1.0.23
[INFO] [stderr]    Compiling phf_shared v0.13.1
[INFO] [stderr]    Compiling phf v0.13.1
[INFO] [stderr]    Compiling phf_generator v0.13.1
[INFO] [stderr]    Compiling phf_codegen v0.13.1
[INFO] [stderr]    Compiling csv-core v0.1.13
[INFO] [stderr]    Compiling syn v2.0.117
[INFO] [stderr]    Compiling csv v1.4.0
[INFO] [stderr]    Compiling serde_derive v1.0.228
[INFO] [stderr]    Compiling serde v1.0.228
[INFO] [stderr]    Compiling ffcharge v0.2.1 (/opt/rustwide/workdir)
[INFO] [stderr]     Finished `dev` profile [unoptimized + debuginfo] target(s) in 10.69s
[INFO] running `Command { std: "docker" "inspect" "1d511dae7aea74825a515e2fd72711be9db3a5b8e66f36b6f6cd48f89c2d4950", kill_on_drop: false }`
[INFO] running `Command { std: "docker" "rm" "-f" "1d511dae7aea74825a515e2fd72711be9db3a5b8e66f36b6f6cd48f89c2d4950", kill_on_drop: false }`
[INFO] [stdout] 1d511dae7aea74825a515e2fd72711be9db3a5b8e66f36b6f6cd48f89c2d4950
[INFO] running `Command { std: "docker" "create" "-v" "/var/lib/crater-agent-workspace/builds/worker-1-tc1/target:/opt/rustwide/target:rw,Z" "-v" "/var/lib/crater-agent-workspace/builds/worker-1-tc1/source:/opt/rustwide/workdir:ro,Z" "-v" "/var/lib/crater-agent-workspace/cargo-home:/opt/rustwide/cargo-home:ro,Z" "-v" "/var/lib/crater-agent-workspace/rustup-home:/opt/rustwide/rustup-home:ro,Z" "-e" "SOURCE_DIR=/opt/rustwide/workdir" "-e" "CARGO_TARGET_DIR=/opt/rustwide/target" "-e" "CARGO_INCREMENTAL=0" "-e" "RUST_BACKTRACE=full" "-e" "RUSTFLAGS=--cap-lints=forbid" "-e" "RUSTDOCFLAGS=--cap-lints=forbid" "-e" "CARGO_HOME=/opt/rustwide/cargo-home" "-e" "RUSTUP_HOME=/opt/rustwide/rustup-home" "-w" "/opt/rustwide/workdir" "-m" "1610612736" "--user" "0:0" "--network" "none" "ghcr.io/rust-lang/crates-build-env/linux@sha256:d429b63d4308055ea97f60fb1d3dfca48854a00942f1bd2ad806beaf015945ec" "/opt/rustwide/cargo-home/bin/cargo" "+562dee4820c458d823175268e41601d4c060588a" "test" "--frozen" "--no-run" "--message-format=json", kill_on_drop: false }`
[INFO] [stdout] b4e7d9fa3ce759b3e5fb832fd7526436a7893b68e10971be90918574691729ca
[INFO] running `Command { std: "docker" "start" "-a" "b4e7d9fa3ce759b3e5fb832fd7526436a7893b68e10971be90918574691729ca", kill_on_drop: false }`
[INFO] [stderr]    Compiling pastey v0.2.1
[INFO] [stderr]    Compiling ffcharge v0.2.1 (/opt/rustwide/workdir)
[INFO] [stderr]     Finished `test` profile [unoptimized + debuginfo] target(s) in 2.52s
[INFO] running `Command { std: "docker" "inspect" "b4e7d9fa3ce759b3e5fb832fd7526436a7893b68e10971be90918574691729ca", kill_on_drop: false }`
[INFO] running `Command { std: "docker" "rm" "-f" "b4e7d9fa3ce759b3e5fb832fd7526436a7893b68e10971be90918574691729ca", kill_on_drop: false }`
[INFO] [stdout] b4e7d9fa3ce759b3e5fb832fd7526436a7893b68e10971be90918574691729ca
[INFO] running `Command { std: "docker" "create" "-v" "/var/lib/crater-agent-workspace/builds/worker-1-tc1/target:/opt/rustwide/target:rw,Z" "-v" "/var/lib/crater-agent-workspace/builds/worker-1-tc1/source:/opt/rustwide/workdir:ro,Z" "-v" "/var/lib/crater-agent-workspace/cargo-home:/opt/rustwide/cargo-home:ro,Z" "-v" "/var/lib/crater-agent-workspace/rustup-home:/opt/rustwide/rustup-home:ro,Z" "-e" "SOURCE_DIR=/opt/rustwide/workdir" "-e" "CARGO_TARGET_DIR=/opt/rustwide/target" "-e" "CARGO_INCREMENTAL=0" "-e" "RUST_BACKTRACE=full" "-e" "RUSTFLAGS=--cap-lints=forbid" "-e" "RUSTDOCFLAGS=--cap-lints=forbid" "-e" "CARGO_HOME=/opt/rustwide/cargo-home" "-e" "RUSTUP_HOME=/opt/rustwide/rustup-home" "-w" "/opt/rustwide/workdir" "-m" "1610612736" "--user" "0:0" "--network" "none" "ghcr.io/rust-lang/crates-build-env/linux@sha256:d429b63d4308055ea97f60fb1d3dfca48854a00942f1bd2ad806beaf015945ec" "/opt/rustwide/cargo-home/bin/cargo" "+562dee4820c458d823175268e41601d4c060588a" "test" "--frozen", kill_on_drop: false }`
[INFO] [stdout] 507da9e674db651dc6c3ba3135e728d20c48f4f63ecfa9f09076062bfaf3edaf
[INFO] running `Command { std: "docker" "start" "-a" "507da9e674db651dc6c3ba3135e728d20c48f4f63ecfa9f09076062bfaf3edaf", kill_on_drop: false }`
[INFO] [stderr]     Finished `test` profile [unoptimized + debuginfo] target(s) in 0.06s
[INFO] [stderr]      Running unittests src/lib.rs (/opt/rustwide/target/debug/deps/ffcharge-b9e91a9e7d2c258a)
[INFO] [stdout] 
[INFO] [stdout] running 14 tests
[INFO] [stdout] test position::tests::default_is_middle ... ok
[INFO] [stdout] test scheme::ion::tests::default ... ok
[INFO] [stdout] test scheme::ion::tests::key_format ... ok
[INFO] [stdout] test scheme::nucleic::tests::count ... ok
[INFO] [stdout] test scheme::nucleic::tests::key_format ... ok
[INFO] [stdout] test scheme::protein::tests::count ... ok
[INFO] [stdout] test scheme::protein::tests::key_format ... ok
[INFO] [stdout] test scheme::water::tests::count ... ok
[INFO] [stdout] test scheme::water::tests::key_format ... ok
[INFO] [stdout] test scheme::ion::tests::count ... ok
[INFO] [stdout] test position::tests::keys ... ok
[INFO] [stdout] test scheme::protein::tests::default ... ok
[INFO] [stdout] test scheme::water::tests::default ... ok
[INFO] [stdout] test scheme::nucleic::tests::default ... ok
[INFO] [stdout] 
[INFO] [stdout] test result: ok. 14 passed; 0 failed; 0 ignored; 0 measured; 0 filtered out; finished in 0.01s
[INFO] [stdout] 
[INFO] [stderr]      Running tests/charge.rs (/opt/rustwide/target/debug/deps/charge-b4f5d9ff7c0a0017)
[INFO] [stdout] 
[INFO] [stdout] running 551 tests
[INFO] [stdout] test ion::classic_6mo ... ok
[INFO] [stdout] test ion::classic_ag ... ok
[INFO] [stdout] test ion::classic_3ni ... ok
[INFO] [stdout] test ion::classic_au ... ok
[INFO] [stdout] test ion::classic_4mo ... ok
[INFO] [stdout] test ion::classic_al ... ok
[INFO] [stdout] test ion::classic_br ... ok
[INFO] [stdout] test ion::classic_cd ... ok
[INFO] [stdout] test ion::classic_au3 ... ok
[INFO] [stdout] test ion::classic_ce ... ok
[INFO] [stdout] test ion::classic_ba ... ok
[INFO] [stdout] test ion::classic_ca ... ok
[INFO] [stdout] test ion::classic_3co ... ok
[INFO] [stdout] test ion::classic_cl ... ok
[INFO] [stdout] test ion::classic_cs ... ok
[INFO] [stdout] test ion::classic_cu1 ... ok
[INFO] [stdout] test ion::classic_dy ... ok
[INFO] [stdout] test ion::classic_er3 ... ok
[INFO] [stdout] test ion::classic_eu ... ok
[INFO] [stdout] test ion::classic_eu3 ... ok
[INFO] [stdout] test ion::classic_fe ... ok
[INFO] [stdout] test ion::classic_k ... ok
[INFO] [stdout] test ion::classic_cu ... ok
[INFO] [stdout] test ion::classic_la ... ok
[INFO] [stdout] test ion::classic_ho3 ... ok
[INFO] [stdout] test ion::classic_hg ... ok
[INFO] [stdout] test ion::classic_in ... ok
[INFO] [stdout] test ion::classic_f ... ok
[INFO] [stdout] test ion::classic_co ... ok
[INFO] [stdout] test ion::classic_gd3 ... ok
[INFO] [stdout] test ion::classic_ga ... ok
[INFO] [stdout] test ion::classic_cr ... ok
[INFO] [stdout] test ion::classic_ir3 ... ok
[INFO] [stdout] test ion::classic_ir ... ok
[INFO] [stdout] test ion::classic_mg ... ok
[INFO] [stdout] test ion::classic_lu ... ok
[INFO] [stdout] test ion::classic_mn ... ok
[INFO] [stdout] test ion::classic_fe2 ... ok
[INFO] [stdout] test ion::classic_li ... ok
[INFO] [stdout] test ion::classic_iod ... ok
[INFO] [stdout] test ion::classic_mn3 ... ok
[INFO] [stdout] test ion::classic_na ... ok
[INFO] [stdout] test ion::classic_nd ... ok
[INFO] [stdout] test ion::classic_os ... ok
[INFO] [stdout] test ion::classic_ni ... ok
[INFO] [stdout] test ion::classic_os4 ... ok
[INFO] [stdout] test ion::classic_pb ... ok
[INFO] [stdout] test ion::classic_pd ... ok
[INFO] [stdout] test ion::classic_pr ... ok
[INFO] [stdout] test ion::classic_yt3 ... ok
[INFO] [stdout] test ion::classic_pt ... ok
[INFO] [stdout] test ion::classic_rb ... ok
[INFO] [stdout] test ion::classic_zn ... ok
[INFO] [stdout] test ion::classic_zr ... ok
[INFO] [stdout] test nucleic::amber_dna::amber_da_middle ... ok
[INFO] [stdout] test nucleic::amber_dna::amber_da_terminal_sum ... ok
[INFO] [stdout] test nucleic::amber_dna::amber_dc_terminal_sum ... ok
[INFO] [stdout] test nucleic::amber_dna::amber_dc_middle ... ok
[INFO] [stdout] test nucleic::amber_dna::amber_dg_terminal_sum ... ok
[INFO] [stdout] test nucleic::amber_dna::amber_dg_middle ... ok
[INFO] [stdout] test ion::classic_rh3 ... ok
[INFO] [stdout] test ion::classic_ru ... ok
[INFO] [stdout] test ion::classic_sm ... ok
[INFO] [stdout] test ion::classic_sr ... ok
[INFO] [stdout] test ion::classic_tb ... ok
[INFO] [stdout] test ion::classic_tl ... ok
[INFO] [stdout] test ion::classic_v ... ok
[INFO] [stdout] test ion::classic_w ... ok
[INFO] [stdout] test ion::classic_yb ... ok
[INFO] [stdout] test ion::classic_pt4 ... ok
[INFO] [stdout] test ion::classic_sb ... ok
[INFO] [stdout] test ion::classic_th ... ok
[INFO] [stdout] test nucleic::amber_rna::amber_u_terminal_sum ... ok
[INFO] [stdout] test nucleic::amber_rna::amber_a_middle ... ok
[INFO] [stdout] test nucleic::amber_rna::amber_a_terminal_sum ... ok
[INFO] [stdout] test nucleic::amber_dna::amber_dt_terminal_sum ... ok
[INFO] [stdout] test nucleic::amber_dna::amber_di_middle ... ok
[INFO] [stdout] test nucleic::amber_dna::amber_dt_middle ... ok
[INFO] [stdout] test nucleic::amber_rna::amber_c_middle ... ok
[INFO] [stdout] test nucleic::amber_rna::amber_c_terminal_sum ... ok
[INFO] [stdout] test nucleic::amber_rna::amber_g_middle ... ok
[INFO] [stdout] test nucleic::amber_rna::amber_g_terminal_sum ... ok
[INFO] [stdout] test nucleic::amber_rna::amber_i_middle ... ok
[INFO] [stdout] test nucleic::amber_rna::amber_i_terminal_sum ... ok
[INFO] [stdout] test nucleic::amber_rna::amber_u_middle ... ok
[INFO] [stdout] test nucleic::charmm_dna::charmm_da_middle ... ok
[INFO] [stdout] test nucleic::charmm_dna::charmm_da_terminal_sum ... ok
[INFO] [stdout] test nucleic::charmm_dna::charmm_dc_middle ... ok
[INFO] [stdout] test nucleic::charmm_dna::charmm_dc_terminal_sum ... ok
[INFO] [stdout] test nucleic::charmm_dna::charmm_dg_terminal_sum ... ok
[INFO] [stdout] test nucleic::charmm_dna::charmm_di_middle ... ok
[INFO] [stdout] test nucleic::charmm_dna::charmm_dg_middle ... ok
[INFO] [stdout] test nucleic::charmm_dna::charmm_di_terminal_sum ... ok
[INFO] [stdout] test nucleic::charmm_dna::charmm_dt_middle ... ok
[INFO] [stdout] test nucleic::charmm_rna::charmm_a_middle ... ok
[INFO] [stdout] test nucleic::charmm_dna::charmm_dt_terminal_sum ... ok
[INFO] [stdout] test nucleic::charmm_rna::charmm_a_terminal_sum ... ok
[INFO] [stdout] test nucleic::charmm_rna::charmm_c_terminal_sum ... ok
[INFO] [stdout] test nucleic::charmm_rna::charmm_c_middle ... ok
[INFO] [stdout] test nucleic::charmm_rna::charmm_g_middle ... ok
[INFO] [stdout] test nucleic::charmm_rna::charmm_g_terminal_sum ... ok
[INFO] [stdout] test nucleic::charmm_rna::charmm_i_terminal_sum ... ok
[INFO] [stdout] test nucleic::charmm_rna::charmm_i_middle ... ok
[INFO] [stdout] test nucleic::charmm_rna::charmm_u_middle ... ok
[INFO] [stdout] test nucleic::charmm_rna::charmm_u_terminal_sum ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_ala_c_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_ala_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_ala_n_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_ala_middle ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_ala_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_arg_middle ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_arg_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_arg_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_arg_c_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_arn_c_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_arg_n_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_arn_c_terminal_protonated ... ok
[INFO] [stdout] test nucleic::amber_dna::amber_di_terminal_sum ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_asn_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_asn_n_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_asn_middle ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_asp_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_arn_middle ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_arn_n_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_asn_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_asp_c_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_ash_c_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_ash_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_ash_n_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_ash_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_ash_middle ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_asn_c_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_arn_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_cym_c_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_cys_c_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_cys_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_cyx_c_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_cyx_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_asp_middle ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_asp_n_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_asp_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_cym_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_cym_middle ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_cym_n_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_cym_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_cys_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_cys_middle ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_cys_n_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_cyx_middle ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_cyx_n_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_glh_c_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_cyx_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_glh_n_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_glh_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_glh_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_gln_c_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_gln_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_gln_middle ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_gln_n_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_gln_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_glu_c_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_glu_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_gly_middle ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_glu_middle ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_gly_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_gly_n_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_hid_c_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_glh_middle ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_hid_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_glu_n_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_hid_n_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_hid_middle ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_gly_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_hid_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_hie_c_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_hie_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_gly_c_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_hie_n_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_hie_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_glu_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_ile_n_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_ile_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_leu_c_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_hip_c_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_hip_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_leu_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_leu_middle ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_hip_middle ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_hip_n_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_hip_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_leu_n_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_leu_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_ile_c_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_ile_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_hie_middle ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_ile_middle ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_lyn_c_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_lyn_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_lyn_middle ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_lyn_n_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_lys_c_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_lyn_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_lys_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_lys_middle ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_lys_n_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_met_c_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_lys_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_met_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_met_middle ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_met_n_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_met_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_phe_c_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_phe_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_phe_n_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_phe_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_pro_middle ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_phe_middle ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_pro_n_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_ser_c_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_pro_c_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_ser_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_pro_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_ser_middle ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_ser_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_pro_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_thr_n_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_thr_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_trp_c_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_thr_middle ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_trp_n_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_thr_c_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_trp_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_tym_c_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_ser_n_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_tym_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_tym_n_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_thr_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_tym_middle ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_trp_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_tyr_c_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_trp_middle ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_tyr_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_tyr_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_tyr_middle ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_val_c_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_tyr_n_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_tym_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_ala_c_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_val_n_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_val_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_val_middle ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_ala_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_ala_middle ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_arg_middle ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_arg_n_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_ala_n_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_arg_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_ala_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_arg_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_arn_c_terminal ... ok
[INFO] [stdout] test protein::amber_ff03::amberff03_val_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_arg_c_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_arn_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_arn_n_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_arn_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_ash_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_ash_c_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_arn_middle ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_ash_n_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_ash_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_ash_middle ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_asn_c_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_asn_middle ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_asn_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_asn_n_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_asn_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_asp_middle ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_asp_n_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_asp_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_cym_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_cym_c_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_asp_c_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_asp_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_cym_middle ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_cym_n_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_cym_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_cys_c_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_cys_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_cys_middle ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_cys_n_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_cys_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_cyx_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_cyx_c_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_cyx_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_glh_c_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_cyx_n_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_cyx_middle ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_glh_n_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_glh_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_gln_n_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_glh_middle ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_glh_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_gln_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_gln_c_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_glu_n_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_gln_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_glu_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_gly_c_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_gln_middle ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_glu_c_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_glu_middle ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_hid_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_hid_middle ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_gly_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_hid_n_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_hid_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_gly_middle ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_hie_c_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_hie_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_hie_middle ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_glu_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_ile_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_ile_middle ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_gly_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_hid_c_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_hie_n_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_hip_c_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_hie_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_leu_c_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_hip_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_leu_middle ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_leu_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_hip_middle ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_hip_n_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_hip_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_ile_c_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_gly_n_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_ile_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_ile_n_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_lyn_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_lyn_n_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_lyn_middle ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_lyn_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_lys_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_met_c_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_lys_c_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_met_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_met_n_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_met_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_lys_middle ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_phe_c_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_met_middle ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_leu_n_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_phe_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_phe_middle ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_lys_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_lys_n_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_phe_n_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_lyn_c_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_phe_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_pro_c_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_leu_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_pro_middle ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_pro_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_ser_c_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_pro_n_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_pro_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_ser_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_ser_middle ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_ser_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_thr_c_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_trp_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_thr_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_tym_c_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_thr_n_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_thr_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_trp_c_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_trp_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_trp_middle ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_trp_n_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_tym_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_tym_middle ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_tym_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_tyr_c_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_tyr_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_val_c_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_tyr_n_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_tym_n_terminal ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_val_c_terminal_protonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_val_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::charmm::charmm_ala_c_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_ala_c_terminal_protonated ... ok
[INFO] [stdout] test protein::charmm::charmm_ala_middle ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_tyr_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_val_middle ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_val_n_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_arg_n_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_arg_middle ... ok
[INFO] [stdout] test protein::charmm::charmm_arg_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::charmm::charmm_arn_c_terminal_protonated ... ok
[INFO] [stdout] test protein::charmm::charmm_arn_c_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_arn_middle ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_tyr_middle ... ok
[INFO] [stdout] test protein::charmm::charmm_ala_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::charmm::charmm_ala_n_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_arg_c_terminal_protonated ... ok
[INFO] [stdout] test protein::charmm::charmm_arn_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_ser_n_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_ash_c_terminal_protonated ... ok
[INFO] [stdout] test protein::charmm::charmm_ash_c_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_ash_middle ... ok
[INFO] [stdout] test protein::amber_ffsb::amberffsb_thr_middle ... ok
[INFO] [stdout] test protein::charmm::charmm_ash_n_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_asn_middle ... ok
[INFO] [stdout] test protein::charmm::charmm_asp_c_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_asp_middle ... ok
[INFO] [stdout] test protein::charmm::charmm_asp_c_terminal_protonated ... ok
[INFO] [stdout] test protein::charmm::charmm_asp_n_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_asp_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::charmm::charmm_cym_c_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_asn_n_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_asn_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::charmm::charmm_arg_c_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_arn_n_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_asn_c_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_asn_c_terminal_protonated ... ok
[INFO] [stdout] test protein::charmm::charmm_cym_c_terminal_protonated ... ok
[INFO] [stdout] test protein::charmm::charmm_cym_middle ... ok
[INFO] [stdout] test protein::charmm::charmm_ash_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::charmm::charmm_cym_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::charmm::charmm_cym_n_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_cys_c_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_cys_n_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_cys_middle ... ok
[INFO] [stdout] test protein::charmm::charmm_cyx_c_terminal_protonated ... ok
[INFO] [stdout] test protein::charmm::charmm_cys_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::charmm::charmm_cyx_middle ... ok
[INFO] [stdout] test protein::charmm::charmm_cyx_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::charmm::charmm_cyx_n_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_glh_c_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_cys_c_terminal_protonated ... ok
[INFO] [stdout] test protein::charmm::charmm_cyx_c_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_glh_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::charmm::charmm_gln_c_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_glu_c_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_glu_c_terminal_protonated ... ok
[INFO] [stdout] test protein::charmm::charmm_glh_middle ... ok
[INFO] [stdout] test protein::charmm::charmm_glu_middle ... ok
[INFO] [stdout] test protein::charmm::charmm_glh_c_terminal_protonated ... ok
[INFO] [stdout] test protein::charmm::charmm_gly_n_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_gly_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::charmm::charmm_gly_c_terminal_protonated ... ok
[INFO] [stdout] test protein::charmm::charmm_hid_c_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_gln_n_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_hid_c_terminal_protonated ... ok
[INFO] [stdout] test protein::charmm::charmm_gln_c_terminal_protonated ... ok
[INFO] [stdout] test protein::charmm::charmm_gln_middle ... ok
[INFO] [stdout] test protein::charmm::charmm_hid_middle ... ok
[INFO] [stdout] test protein::charmm::charmm_hid_n_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_hid_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::charmm::charmm_hie_c_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_glu_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::charmm::charmm_glu_n_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_gly_c_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_glh_n_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_gln_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::charmm::charmm_gly_middle ... ok
[INFO] [stdout] test protein::charmm::charmm_hie_middle ... ok
[INFO] [stdout] test protein::charmm::charmm_hie_n_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_hie_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::charmm::charmm_leu_c_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_hip_c_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_hip_c_terminal_protonated ... ok
[INFO] [stdout] test protein::charmm::charmm_hip_middle ... ok
[INFO] [stdout] test protein::charmm::charmm_hip_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::charmm::charmm_ile_c_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_ile_c_terminal_protonated ... ok
[INFO] [stdout] test protein::charmm::charmm_ile_middle ... ok
[INFO] [stdout] test protein::charmm::charmm_ile_n_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_ile_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::charmm::charmm_hie_c_terminal_protonated ... ok
[INFO] [stdout] test protein::charmm::charmm_leu_middle ... ok
[INFO] [stdout] test protein::charmm::charmm_leu_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::charmm::charmm_lyn_c_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_lyn_middle ... ok
[INFO] [stdout] test protein::charmm::charmm_lys_c_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_lys_n_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_met_c_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_lys_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::charmm::charmm_met_c_terminal_protonated ... ok
[INFO] [stdout] test protein::charmm::charmm_met_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::charmm::charmm_met_middle ... ok
[INFO] [stdout] test protein::charmm::charmm_met_n_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_leu_c_terminal_protonated ... ok
[INFO] [stdout] test protein::charmm::charmm_lyn_c_terminal_protonated ... ok
[INFO] [stdout] test protein::charmm::charmm_leu_n_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_lys_middle ... ok
[INFO] [stdout] test protein::charmm::charmm_lyn_n_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_lyn_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::charmm::charmm_lys_c_terminal_protonated ... ok
[INFO] [stdout] test protein::charmm::charmm_phe_middle ... ok
[INFO] [stdout] test protein::charmm::charmm_phe_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::charmm::charmm_phe_n_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_pro_c_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_pro_middle ... ok
[INFO] [stdout] test protein::charmm::charmm_pro_n_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_ser_c_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_pro_c_terminal_protonated ... ok
[INFO] [stdout] test protein::charmm::charmm_pro_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::charmm::charmm_ser_c_terminal_protonated ... ok
[INFO] [stdout] test protein::charmm::charmm_phe_c_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_phe_c_terminal_protonated ... ok
[INFO] [stdout] test protein::charmm::charmm_ser_n_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_ser_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::charmm::charmm_thr_c_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_thr_c_terminal_protonated ... ok
[INFO] [stdout] test protein::charmm::charmm_thr_n_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_thr_middle ... ok
[INFO] [stdout] test protein::charmm::charmm_thr_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::charmm::charmm_trp_n_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_tym_c_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_tym_c_terminal_protonated ... ok
[INFO] [stdout] test protein::charmm::charmm_trp_c_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_ser_middle ... ok
[INFO] [stdout] test protein::charmm::charmm_trp_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::charmm::charmm_trp_middle ... ok
[INFO] [stdout] test protein::charmm::charmm_tym_n_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_tyr_c_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_tym_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::charmm::charmm_tyr_c_terminal_protonated ... ok
[INFO] [stdout] test protein::charmm::charmm_tyr_middle ... ok
[INFO] [stdout] test protein::charmm::charmm_trp_c_terminal_protonated ... ok
[INFO] [stdout] test protein::charmm::charmm_tym_middle ... ok
[INFO] [stdout] test protein::charmm::charmm_val_n_terminal ... ok
[INFO] [stdout] test protein::charmm::charmm_val_n_terminal_deprotonated ... ok
[INFO] [stdout] test protein::charmm::charmm_val_c_terminal ... ok
[INFO] [stdout] test water::opc3_hydrogen_symmetry ... ok
[INFO] [stdout] test water::opc3_total_charge ... ok
[INFO] [stdout] test water::spce_hydrogen_symmetry ... ok
[INFO] [stdout] test water::spc_hydrogen_symmetry ... ok
[INFO] [stdout] test protein::charmm::charmm_val_middle ... ok
[INFO] [stdout] test water::spce_total_charge ... ok
[INFO] [stdout] test water::spc_total_charge ... ok
[INFO] [stdout] test protein::charmm::charmm_tyr_n_terminal_deprotonated ... ok
[INFO] [stdout] test water::tip3p_hydrogen_symmetry ... ok
[INFO] [stdout] test protein::charmm::charmm_tyr_n_terminal ... ok
[INFO] [stdout] test water::tip3p_total_charge ... ok
[INFO] [stdout] test protein::charmm::charmm_val_c_terminal_protonated ... ok
[INFO] [stdout] test water::tip3pfb_hydrogen_symmetry ... ok
[INFO] [stdout] test water::tip3pfb_total_charge ... ok
[INFO] [stdout] test protein::charmm::charmm_hip_n_terminal ... ok
[INFO] [stdout] 
[INFO] [stdout] test result: ok. 551 passed; 0 failed; 0 ignored; 0 measured; 0 filtered out; finished in 0.15s
[INFO] [stdout] 
[INFO] [stderr]    Doc-tests ffcharge
[INFO] [stdout] 
[INFO] [stdout] running 1 test
[INFO] [stdout] test src/lib.rs - (line 25) ... ok
[INFO] [stdout] 
[INFO] [stdout] test result: ok. 1 passed; 0 failed; 0 ignored; 0 measured; 0 filtered out; finished in 0.00s
[INFO] [stdout] 
[INFO] [stdout] all doctests ran in 0.60s; merged doctests compilation took 0.60s
[INFO] running `Command { std: "docker" "inspect" "507da9e674db651dc6c3ba3135e728d20c48f4f63ecfa9f09076062bfaf3edaf", kill_on_drop: false }`
[INFO] running `Command { std: "docker" "rm" "-f" "507da9e674db651dc6c3ba3135e728d20c48f4f63ecfa9f09076062bfaf3edaf", kill_on_drop: false }`
[INFO] [stdout] 507da9e674db651dc6c3ba3135e728d20c48f4f63ecfa9f09076062bfaf3edaf