diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/AA__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/AA__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..b94c41e875e6bcf0aa6e1ecfa53df980f9cbac30 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/AA__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:b699ae4e38609b99bc9226809e89aa298c1f36e69b606f53182faa9fd0075b0d +size 5157229 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/ANKSMIEA__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/ANKSMIEA__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..44d0c360514cbe9a30673cb1260e290bb30e4a9d --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/ANKSMIEA__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:ef3caee3a07e1ab493aa1c3bf343c2bf24b214ac23e8f29f4056f6920b37a074 +size 26362749 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/ARIP__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/ARIP__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..425227c6d952792ee0406674e8e91a21989b2c73 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/ARIP__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:883689037507b8590b70071d199febab282ab94795fe5e62ba364dccbca2e695 +size 15325667 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/CCVH__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/CCVH__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..91c5530d237102e643d413d7c16703c3230aab68 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/CCVH__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:9463a04b43da10918833572b542380b9804f9091bd95b8c3f10f833cc4379bb0 +size 12804626 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/CE__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/CE__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..a6a69b15fb0daef661952ab95b254ddc24be422d --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/CE__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:ab2af63242af53c0feb7b5344a4052ac7725aab37532df82978b56f9045500a3 +size 6487938 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/CGSWHKQR__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/CGSWHKQR__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..067c1de6a228115803f9aba8e81a24a38d61cca4 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/CGSWHKQR__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:c5955ddc75c1d931ad53cb0f27555c571d1edca466b4561774834e189a1d9de6 +size 29611044 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/CIPQ__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/CIPQ__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..2b56c128748618594725962777fe749fc61041d3 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/CIPQ__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:32baaf1ae77600763b5f905eda364f89a5ad8d833c33b97b963f5a6c54ebc293 +size 14072636 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/CLCCGQWN__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/CLCCGQWN__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..dfad1b64e0a1903a9a56c9a89d36894af200975a --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/CLCCGQWN__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:43dec8158f54e2e97ec6c1074e3fb82ec964f0d611f7c2971407e7059c9100ae +size 25577288 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/CL__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/CL__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..4ab14d277359239e45da8f4cbdad44746f9217c7 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/CL__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:6bc24b3dd8abf987a5d292a1e4513f2c8bec7dd317c0cbc381d5ec7bf63f71e1 +size 7344721 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/DDRDTEQT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/DDRDTEQT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..8ca9be916e6f035ecea70235b4d17fa21a783bc0 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/DDRDTEQT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:c5f198b46de771848f0f5191afb35e343473cf26474dc403eeabc3b0c70797a3 +size 26809162 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/DEMT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/DEMT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..8ec176d5562a76e3d39c159f63591863d818840b --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/DEMT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:7a29940b1d671d1a6f6f03b991abb963b877602b62ac8d819fa0058d46e9f299 +size 13425900 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/DGVAHALS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/DGVAHALS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..2d53850929d638d554b0800de25f5734ab5a3a2b --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/DGVAHALS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:c4a4fd579698d234d02beb5ff1d2d7bf6bef250767316143af3244f14133e6ed +size 22915262 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/DG__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/DG__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..8808fe46dc3e39ba6e76a21be2f28d0874e5b5b7 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/DG__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:e56543f978c5ca1c98f35e141492edd9cc6f9bc9962c937d2408ed8634f7a873 +size 4946584 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/DI__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/DI__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..48d0cd60978abc6527c9f83b320c44cf7d260c2d --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/DI__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:886011bb6da86a79d6672e6e4f59d1682f095a5c82d6d54a9637e1b427cb564e +size 7548996 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/DMTL__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/DMTL__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..2bef533cc26ba6bd1936b51af1a09c605379ac5a --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/DMTL__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:2f335d5be56c38974f9eebb0e9fabf8358163dec60f14357409fa6a9ba9467de +size 14291369 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/EHQW__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/EHQW__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..fc5399f32f9ca81c0ed136e1d26ac71522fae52c --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/EHQW__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:1736944d4349b9a4f79780b5637ceba98708cc1383c495775e1b5e72f4de2d9c +size 16668386 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/EKYYWMQT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/EKYYWMQT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..627d452578504c71ba79b95ea2fa2cae5c4ff6fa --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/EKYYWMQT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:25068dce0d229d7732516fa2f9e8d472961907105ad6bef8d6748a190b07ae2d +size 33474353 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/FESD__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/FESD__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..ed722608f1a1fba266b307efa59e7a91fa640184 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/FESD__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:72ec4683d1a92ce39620dbbf9be31b0b16eedacc91e8564ae5f72579dcae8304 +size 13417987 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/FK__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/FK__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..b211c0d462868555b576cd72b976b563164938b1 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/FK__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:cd9da4c0d3618a03e1fcde4f87cc5c94b276aef666f0058d604244d998e9b674 +size 9938345 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/FWRVDHDM__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/FWRVDHDM__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..fa1e0ff1a1379f5f86425fe6fbdf982905e8d988 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/FWRVDHDM__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:8505bdfc24baea12ecf99be167d07e4545af6dfca7bd5ea8f06f360d5734b12c +size 31569702 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/FYYY__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/FYYY__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..bd692743e189962509c78f3ba9b0c95f73f18c11 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/FYYY__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:42fd735ac8800a508379276a1e1f88ec4b954e4d3a6734e773e7439bcea73a94 +size 18810755 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/GDTI__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/GDTI__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..305cfbc6848cdce9856f74acb50d1174f176c20a --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/GDTI__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:cf72767943adbeb969abc3f201c7379cef68e91a12db82cda1369da10eb3cb15 +size 12105391 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/GGRS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/GGRS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..4f4ceb483b4c8b141cae483ed23036ff008385b0 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/GGRS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:09e5135196808036f53e983c268ba5eb7696c968443aad9968d35c90c12c1076 +size 11469476 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/GNDLVTVI__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/GNDLVTVI__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..7dd6d59960ff8dce1a8ab7e260b7545f63b4ce32 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/GNDLVTVI__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:d13fc5289584709c7dc3e21b562682acdbb111a4bba1bf1ac17a62de6950984a +size 26118436 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/GYDPETGTWG__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/GYDPETGTWG__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..c07e347ff26b9962aaeb20a71e10c15aa19d4f29 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/GYDPETGTWG__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:27c9b1c80ed82c27a5e6044648fb36da46e43f3fa8f55caa530fbe63d0eb0d9a +size 30117105 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/HEAV__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/HEAV__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..091561728500c4703e78d3cf0da249bc5f4753e5 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/HEAV__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:ae92801bdafcaf8066b28e82fd3c4b0dafc71822be2eb02c59a8339cef853732 +size 13414305 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/HL__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/HL__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..c4f206220d46326014ce89969ed301909561f4eb --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/HL__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:f209b0871763b94efc1e94e8918ee06ac17604f35da8d1e8853c89b96ccbd402 +size 8644000 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/HM__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/HM__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..cde575133606a4b577148529325ba85ede8f20e3 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/HM__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:daf91831ed18d87027c3c7fbf08338f6416a0b5cfe68572d08af4eca3e891157 +size 8233199 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/HQVS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/HQVS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..73aa8b5f105ddf40e2a1d9407bcb1af94f7d7222 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/HQVS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:300ddb0618efb15521d5eb21b4e3b214b4adbaa2bfb86ada2c75ca658030976a +size 14062369 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/HWHSLICK__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/HWHSLICK__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..1129c9c468503d04af78f6b60208e02ed9e47f0e --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/HWHSLICK__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:a4e7580ba8374db5ae483bcc571b1e5d7da08284f8b1fe38d58f11619b0462dd +size 31095902 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/IDHRQLKW__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/IDHRQLKW__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..77a51c020bda74d6f63150476315997678c4eaf6 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/IDHRQLKW__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:f01005d52b27692c3808011185eda2ef89936c7c72244f67fe2ea60ab12fd69b +size 34093027 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/IFGWVYTG__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/IFGWVYTG__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..3d79bae2c75f9e2c15b8dbf24dee88408a081208 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/IFGWVYTG__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:4f7121c3296e926b5ff4e4528afcd79347be12f42c985dba872bc68fa13b73c1 +size 28514766 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/IK__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/IK__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..612ffa56613da27ac237b1c7e561909e307b61a7 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/IK__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:6cc611eed6ee3c2258bc9496cf3cc329b453a917148c87c381ca74916700742b +size 9706205 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/IM__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/IM__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..785f0fc45f4535a0098c01fc14920b234689ecf1 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/IM__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:92b803e33aaea297e6d78a7038bf18947877b03446084cb6d8f3abb8a5060910 +size 8640301 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/ISKCKNGE__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/ISKCKNGE__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..6211844ad01b1db618a1518e03f31d0aa88c0fb2 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/ISKCKNGE__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:013156c9810a90fc46efa35b71951bc1449432a707ce443ce77a41b18f7befea +size 27019346 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/ITYL__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/ITYL__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..f201cb1ec3be2c30351e2d500980301f692aa611 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/ITYL__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:a6efb67165296f761fdfed2feb25ee35b43175ead431169277037f4261776a37 +size 16630262 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/KG__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/KG__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..8bee37693417d3e77b23f5d4257e9d03eec1462e --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/KG__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:39cc7f70cff7a249485cfc01125fa4043ca51b6176228e7b91cbe3b56b701493 +size 7111039 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/KKAP__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/KKAP__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..b1785d13ce913c23f857e577e7d4721d76b05189 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/KKAP__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:161c72871a880801aaf1d8cb57e4b89e7f8179b0a00541eacbc33d11b3db1cb7 +size 15546858 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/KLLR__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/KLLR__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..acf823e8cde61cd2f3f067eb1197c9d6c618a2eb --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/KLLR__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:c64c4f193fde860f54463501510703a1fd16e947690313262a1e5fbdbeb42a8e +size 18983671 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/KRRGFFLE__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/KRRGFFLE__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..9aad6757207eecffdaf8338b2667552537794d86 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/KRRGFFLE__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:f34b0a05b81fe759c943a6d4d665ddd4581b389980e14c828244f2d0e3a59591 +size 33440802 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/KRWN__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/KRWN__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..b9f106a6fc04e3575989a89d1f7102159265f4df --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/KRWN__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:1d04b87d2d9f503612134d222c11f55c82c969b178e6f6d3e3af621a1d4c0e01 +size 19022918 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/LE__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/LE__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..8bd7abfc8a8af4c3471ac74e75551873b1936c12 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/LE__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:c00e9877dbba6a0bfc2cdd183fa43510a292f2a8124df08ce140b19cd3e41063 +size 8199762 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/MAPQTIAT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/MAPQTIAT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..068360e911fc706ee8cacd69b85c0d7b7b6479f2 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/MAPQTIAT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:3a0ac17e6b7aa8960ae0fc338f4e8446dc536a4285b580ebd85773cf3674e7f5 +size 25713416 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/MQ__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/MQ__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..6fa7b9f78217deef729fb9b258272099d01b4325 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/MQ__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:0e860b0fb2cbebee4403ffa6c4dc1da1dd2d63db977c03af2fe28ddc19a0a7f8 +size 8223382 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/MRDPVLFA__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/MRDPVLFA__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..b543935b8f412d1cc4d933db5222e88226086d71 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/MRDPVLFA__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:c2c32d04f1326ee0685ddbb8f74e9804ffb1e1f15c0ab448c08decaaa2f604cf +size 29370203 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/MYGRNCYM__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/MYGRNCYM__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..0e0a8d040627ab03fc4b5a20012d500af70ceba5 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/MYGRNCYM__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:40fe7024cc188003ea85a108f6c62bf26c53ba170a0f5edec142b4cb8b2b37e6 +size 29459660 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/NA__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/NA__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..a2597d9714ed71633f43bdbc84e7779398c60be5 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/NA__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:241c1e74999362ded8a078c2e3cdb51fc2fa89e7fff49a63f1a5425ad55c04f3 +size 6035565 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/NCFG__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/NCFG__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..3c99af453af3faa84fddb16c75fc469fc851dfed --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/NCFG__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:6e5e9feb3da7c5b2f425539337c53c4b25292112f4f9feec7f109aa463719355 +size 12143328 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/NHQYGSDP__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/NHQYGSDP__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..5b1f9c6cebed31266afabc26d7852f6f600f2b75 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/NHQYGSDP__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:2f72004120445f65eb6c3072c94da039796cf091fca0ae99f34de4204ac9a9aa +size 25321890 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/NKEKFFQH__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/NKEKFFQH__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..de844c3c97f3c1ba0691ad731f7cb6ca7713b3af --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/NKEKFFQH__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:51d0ecebe0e34cf87dc2897f124c2a4953caa2adcbafd650060893af9d640c7f +size 32579660 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/NPCLCYML__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/NPCLCYML__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..36c70572be96833a31f2d94152a05f762d0cd001 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/NPCLCYML__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:d82b99c1f56a5113e5c2c3211c79c2edf49abb102ca0f2c4f67f15eb78bbac9f +size 28117292 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/PGESTAES__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/PGESTAES__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..b95f8a3e54421892f799cfdd5830be1444b0186a --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/PGESTAES__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:0131d243e1033d9a90cf3fbaa00335bb0502ed8f09e932006b33bb2468dbbb8c +size 21860422 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/PG__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/PG__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..2f99fb0f4590dd954b1c63a32f6dc46a6b1a64bd --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/PG__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:46592765ae995a212ffa03a7632ffb52f68904f126836454cab333ae246b8d3f +size 5379685 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/PLFHVMYV__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/PLFHVMYV__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..350379b6a75c719d7e7989160d7c34c2262eb355 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/PLFHVMYV__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:0c25237b3cd781e50a106082df5aa8c1d0f4f276b93621026bbc621bc891584c +size 31078537 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/PPWRECNN__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/PPWRECNN__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..84582ee372ab4c6ffacb254714e78d569436e621 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/PPWRECNN__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:71ea989d17bde74f22c904269f129638d96f4b13a9b5a332c2723907da87368d +size 28971381 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/PQIF__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/PQIF__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..ad922fd71d9f8d3940a551c7e40c1e2776891010 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/PQIF__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:ea719200d75d74dff993d9b2ef34636bae7edb1cb2a84f77abab7973769b285a +size 15995484 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/PYIRNCVE__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/PYIRNCVE__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..ac1bf015a6836b5b1ab86f2e8ca5cda737653383 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/PYIRNCVE__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:79af1639b8dd3a3346a7afc499ff7d9f20511ac6070ab848f5b3033ae396c741 +size 29820405 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/PY__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/PY__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..ed5df5996bcc1e39a88643b5bce5a547bb0baf1b --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/PY__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:1ee6cbc28916410638280ae39b6289ed824a3105c9cb05e24c9cb939dc5d1ad6 +size 8429611 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/QAKR__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/QAKR__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..c86a46ddc5ce0440aa61e9c4c15a903b01d7aabb --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/QAKR__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:459011b8afca1b3193a4a159fb0b23e54efceb30101cc90661a2e0a5a25b93b8 +size 16641116 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/QR__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/QR__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..7eb24936ed681b0da81354f16dde9bd37232c6ca --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/QR__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:055df6775726873dddfeddfb47b13f2456c79b542321ce765189a42dcb1e6ccc +size 9731007 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/QWNL__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/QWNL__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..3e97def67b03e3b872630221bc102f56c266490e --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/QWNL__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:4dd62eae27e400b7183c47143f8c96afd1a3ce87811f9c82fdd21bb8aaf546d2 +size 16878209 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/RLMM__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/RLMM__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..e6a98b42f73395b67491e4212189978b598b0c21 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/RLMM__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:e72ad907315ca806593f3f76ac904a6d601c70cd3f0a31df14bec84eb1cad449 +size 17520103 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/RL__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/RL__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..bbbb4b37a5532e2a6bc47b020b103708c5a8fd2b --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/RL__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:9ecc77562e21b87171507b59c351277a7f1a8a21a4e3e287497360cc63397934 +size 10142091 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/RT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/RT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..9e9dc2478208511e203ed292233cfa2c64d5637b --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/RT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:5550dd87698520e8b6784628023a2f60103354d7d108fd0054d5d86ae0fde47d +size 9068253 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/SHKS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/SHKS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..faa95558b0333887f3770803b34b54ad0ed61207 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/SHKS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:65eb78f2b4303f500dc53ccfb462f974df4008c4f248f61ed0cc8769b37e2143 +size 14061508 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/SPHKMRLC__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/SPHKMRLC__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..5dd2f1782a792fb1aa853df919d1368dfe3e2925 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/SPHKMRLC__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:f6e87f0cb4f601fd21cc11e7d5a2aff1fbf6474bb4e77dccb6330d2910b538a2 +size 30021310 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/SQQKVAFE__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/SQQKVAFE__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..c75276587b95d92b0d5b8013e19bfb160f7dca13 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/SQQKVAFE__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:be7df2b4e672ff3fb91f00b474963678d3b54c3751009c0709977d7e0090100b +size 28502506 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/SS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/SS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..d5d68986050179601f408a57cc3e0565a72a3907 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/SS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:c13a88bddfd6356ee3bc49fb1d4aef08dccb87f6823897649ed9f14baba704f9 +size 5595334 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/SVND__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/SVND__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..1957127c34efc66f2896238790cbc95fdfb91cc8 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/SVND__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:c543abc39bd68f1878400a4250b3feb9e091088aab60a4efd707f041df286aa2 +size 12327005 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/TAPF__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/TAPF__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..fb1051be5423280cefe507313d106a0e52731ea9 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/TAPF__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:1988af0b5f1c25a432cb47da0c47575fd0d6e27b5939881b6bc88d038a291634 +size 13407249 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/TD__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/TD__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..211016fa62b7fc8e9fdf9b583309d6eda681c18d --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/TD__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:021a58ff71c3472739effddbaf01d4c30bf2d283a555e6dd01b6b8bfc1f09a47 +size 6469767 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/TMWC__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/TMWC__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..81eb566b139ba8ca582410c92508afeb2579967a --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/TMWC__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:c764aa4e2b0be4b6fafb8228193f09ceafb5916bef7a0dbfa6cafbda20bee89b +size 15177929 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/VF__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/VF__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..8809ff127ac6ed02a5b8145c3515aafaa6ea0442 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/VF__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:77779af6a72de3f6b42bc90c12036d44b18f9dbe61ef873a938945475a41db6b +size 8633541 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/VS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/VS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..e9f81350f1572af94a2c4c9a7b3b6ecc1ec7d484 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/VS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:e15826a95be8613c75238815fcd37a4a1d0db3ce0a9ae8a162d39d35de6a082c +size 6675886 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/VWIPVIDT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/VWIPVIDT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..abea769daeca6e0c8ed0be795ca3af1d6d1b5673 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/VWIPVIDT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:0e4bb0c4f93b5172a102b5a7f068c934430abd732e970487d36145aa877966cc +size 29780867 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/WA__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/WA__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..fd4cadfcb692adab77748c7ce7bafefdf36a9963 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/WA__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:6c867ca62270a998d1510f4acb8b3b571ff8ecf660b896c3db771c1d2c9aa622 +size 8219864 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/WDLIQFRQ__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/WDLIQFRQ__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..e6ebe1d3b49f947b617b5e6774b7a25c41eddfcd --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/WDLIQFRQ__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:3e8d6440e65c7e4b4bd6f02c87698f10614ee737c544669a44202bf08ac38404 +size 33677202 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/WH__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/WH__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..ac99a40a59ef41d4184d3a321a62981353579ded --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/WH__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:7a0d8ec3a37c0db5790b1148eca13b8f87a6791f3e84262b9f8b819d19a0bd9d +size 9747193 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/WNMA__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/WNMA__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..81fc893e3f3e119bd86d9aef1c58c40e33592c6b --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/WNMA__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:064574237cd881e981d4e8a187064536e2208330d659668914208825b7d4d242 +size 14953650 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/WS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/WS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..817a121ec2f308e81d7f0e2a471777044462ac49 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/WS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:c574a94b9aa4ebf020159a1250d076c8544d7294996632d00513e92b03203334 +size 8442635 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/WTYAFAHS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/WTYAFAHS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..b4bb36c16b9c25701cb85fcc88edfa87930d97d9 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/WTYAFAHS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:b0e223fddce0b756dd4cb343136c83fbd6d60f5b9084b4f0c84a67bc3af35b0f +size 28320614 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/YC__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/YC__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..24aefd2354a9788080d7413c7669436060047231 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/YC__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:225a48ba2bf5e56f0a024dd1401f43b3ad0d7b09879ecb7637d86c90c06eef4c +size 7799723 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/YFPHAGYT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/YFPHAGYT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..380c1dc5efe84a197a3267e3ec1aae3d8562ee79 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/YFPHAGYT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:e27081363e5af98000a4b0b2cbe5146741edae799f194a7760233ad8317f29a7 +size 27667441 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/YQNPDGSQA__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/YQNPDGSQA__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..89391f29c85872602a3e6057207e8259433ccb6e --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/YQNPDGSQA__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:f81c12f209bcf089d5a177dae9dc6a407295cd5039178e496515ee37bba32a5c +size 27499522 diff --git a/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/YQ__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/YQ__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..a2be31f7c5febf90fa33c4e46a8f7fcebdfff050 --- /dev/null +++ b/checkpoints/0_049B/core/00256_ws_scaling/dipper_0_049B_core_256_ws_scaling_step_59080/YQ__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:ffa2a777288d57288205d5a6dd68b8c50014093f532682f7cf42449d91a0a43d +size 9092102 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/ANKSMIEA__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/ANKSMIEA__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..47ae532711a2e522c8adfbffbc5e1423ef948b14 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/ANKSMIEA__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:d61871b02edbdf9c005817819b71f91211f564245dea92667b0440113eb2bda2 +size 29131174 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/ARIP__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/ARIP__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..f51daacc083e322dbd3f11e8b56356981f92391d --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/ARIP__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:a1a8a582bccc3361de362bcaeadc6b8b4f27010b9f861354b3ffa012f12388c2 +size 16926794 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/CCVH__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/CCVH__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..38247769b6c33a2771145e9ee95d732ce599b790 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/CCVH__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:52ddb2a3adbd3572b527b07b122e2278e52e6501fb022ac0fd5e8722b993e3f6 +size 14106851 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/CGSWHKQR__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/CGSWHKQR__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..84bb8de7d2b8f76b9a08ec2f6a491e4a892cea64 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/CGSWHKQR__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:5dd4081950728ee9eb940d43f86f359bd2bf0eccb32d5adafa31e5f6591f565c +size 32767597 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/CIPQ__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/CIPQ__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..455b27ec472a90db3b4adc392c5327b62c351118 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/CIPQ__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:5537564a5316a629ef4bf8ed905c7533852117773f90b772ca0ded90c4cdfe5b +size 15514631 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/CLCCGQWN__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/CLCCGQWN__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..4c45493e78460d99c9336f063af22071bdd56cd7 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/CLCCGQWN__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:5be8cb6591dc57e7d0ff89ba65b55153582a79feca9d07faa3ad26f2b1c3b9e9 +size 28264241 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/CL__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/CL__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..db55042e9ccc8f44a1e107b4d6c32d5874b931c7 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/CL__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:ea0c5525da778622b0866f383435d6fa433cb337de935403ab74e16b84786cfa +size 8084409 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/DDRDTEQT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/DDRDTEQT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..d41be985512747f185c56780a512c9832e292495 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/DDRDTEQT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:c363071875f4944be553a533c7cdf7dbc1868b2fb2153fe51272e987733be51e +size 29685917 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/DEMT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/DEMT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..3a72571ae7f7fcf33f51df78c4d06453d5af77ac --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/DEMT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:56bee5605995ee0b76f9302870e31b5b7297c6d3d1e57a7c9087c6f2f4cc4719 +size 14821093 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/DGVAHALS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/DGVAHALS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..8bf6c643b8e8b97f20efb248739e90e6c3542550 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/DGVAHALS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:2f7669e532065f2a8d90a7ba3df0f2b22354029918b788d3b721b475d294c7b4 +size 25340243 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/DG__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/DG__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..fffb20afffb6db171ea8380a3994bfccac244da4 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/DG__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:31746701759c1c002b80c8a967a422af0e6729ed129de1a705ca51cc7ebae6bf +size 5451552 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/DI__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/DI__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..ada24fda17d91e4c4d07ad2f622fd7ed97cf9ecd --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/DI__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:6545376b83dd9b95ff05eb578f8d8cc74d7f8ead61664b2351bcb3ee9a7340f7 +size 8322415 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/EHQW__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/EHQW__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..b01c9abb4303a1cb47a1c111590b0d099cc4d254 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/EHQW__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:c0ba88a29229f59db6afd75d9c7f69d82eb30dd4caa70b512e11855952bab082 +size 18406690 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/EKYYWMQT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/EKYYWMQT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..3391b8fc8e8e996da432d4e7b13d86a2921d5082 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/EKYYWMQT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:e0c0cd5a7ffb662584229a4276749b11ed4d090fb3a606558ec928159553e048 +size 36995625 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/FWRVDHDM__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/FWRVDHDM__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..b6d47b5f462c3bbef0f4e9586a11903c2ad75f40 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/FWRVDHDM__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:73ee24049dc6115c3275813a4899a46b9d992aa2e8973de85138dbed74b1856c +size 34921802 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/FYYY__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/FYYY__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..5c43653f5cbfbd59dc671e50eafe4dd6d9357a67 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/FYYY__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:79b51bc0eea2fdd4d1ccd1b6a0b6b22eb71afa6b0ac847ed6bbbc30589234ed3 +size 20745323 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/GCDE__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/GCDE__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..27887845980ad967a4bcddf023a93f26aa580b6c --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/GCDE__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:e8baacbb07c6dfe5f2de4b742b6180a020996b929b1f99d6dc03ef3584082c24 +size 11724370 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/GDTI__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/GDTI__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..40aa8cd0fb9423c80a00a25e661e0ab36e0d4c6f --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/GDTI__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:60e50d07e206a07694d9e59068896d52e02eb99b64515b7ed466f1e5258b2f8d +size 13367580 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/GGRS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/GGRS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..7cb2563fe8955a41bab9d5b6f275055a396eca01 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/GGRS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:b29bacc09b89d8161b1d43404b8bad0428ba3707d5b28fae3ddc9f1425f84120 +size 12666861 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/GNDLVTVI__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/GNDLVTVI__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..234a6d9293c2cccaeaeb5d41d832014a39b8d77b --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/GNDLVTVI__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:1f115b2376aaa8190e10ce270239ebbaab485e3403f39b8d3ccd01e28514f4fb +size 28871128 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/GYDPETGTWG__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/GYDPETGTWG__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..683e8fdaa8240ca86a763a8659c48d00c57b9a62 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/GYDPETGTWG__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:85dc5d65b61315429de090b6152c6501caff39456c0ec7ac64453bff6271573b +size 33312656 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/HEAV__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/HEAV__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..87c65e86c903a7cedbb12a78a866a44a66ff8072 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/HEAV__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:fb0bc55baab046ea5b29b39d8f6425e00ec4bfd8c73bcf5a3f8ef8732909ca09 +size 14802530 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/HM__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/HM__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..8ade21d5bf91dc8b82c1c9080db6860ce384258a --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/HM__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:7306e49d40dcffefefb884944ba7c0a77048765bf76e5d971bc74ff49098538a +size 9066777 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/HWHSLICK__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/HWHSLICK__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..bc15dc9e5804472d8f27dff07170bc8d97d57af0 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/HWHSLICK__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:65df947b96a9e9be40c89f8bb00b7646e97f4eed02eabd7620dd1e0ac175ce60 +size 34360486 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/HYGW__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/HYGW__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..548e87913be625ea8404793f3e6b76741dccd0fb --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/HYGW__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:5a538bdaa840c641e8e10a8a64b41fded1fb2c7fcceeeadd9b3d1fb984a86d22 +size 17444658 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/IDHRQLKW__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/IDHRQLKW__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..5e4e0e058c825c8a4b0171f785c1e0628a220283 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/IDHRQLKW__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:ee331e98ecb9a8ddbc3695bcb628a42815b9888e387023ba20b9addf7d36f7ec +size 37700170 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/IM__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/IM__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..36e8b7eefaf7d08ac97d07e7cdd94e39e3c3eb02 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/IM__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:5aaf18f29c56e57b9b998b59c3a8b4d63d80d696cf8280efbe5f453373446598 +size 9513715 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/ITYL__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/ITYL__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..bcd1e95cc0a1fc9bc98f4e5cc51b897390172d9a --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/ITYL__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:321fc9666d7a35bd06e3042de5f08376787a287c75d67a52de3a12b24875f7b6 +size 18350871 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/KG__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/KG__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..912b57c4b6f96b308d8c8740757439fdf3ff4d74 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/KG__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:96c6fdafbcfb0918d64341b05596050a4ca55d50c07f65f1599d20946cf62152 +size 7833824 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/KKAP__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/KKAP__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..d8443cee79006f2c67e1e40d60216329e8a760be --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/KKAP__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:30b783364d79a0ab3ba5454a0cb70d1dbc80a80640b026a918be8fd1b0ac56ee +size 17152424 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/KRRGFFLE__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/KRRGFFLE__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..645208588dfa25ba52a507a794d670693003bdea --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/KRRGFFLE__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:8386368cb673ac65eec686e8d0f45618bf6963cad0ddcffb34a699d1f0910d1a +size 37005045 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/KRWN__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/KRWN__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..cc6b7b2531fcdff548da95d2ac42775edfbfba66 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/KRWN__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:11b656d0829f8979403f94d9668574920f453da48c33c83bd01bddaa86468a73 +size 21014042 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/MWNSTEMI__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/MWNSTEMI__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..d10693feb383eeb0efbb303f937d85f3f36b9928 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/MWNSTEMI__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:d08faa193eea0e388ef4a43c9bf6de3421f86f5ab3b3a90e329318fd02431a0d +size 32263142 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/MYGRNCYM__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/MYGRNCYM__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..72df6bcf292accfee9cef9ebc82d5d884ecc400f --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/MYGRNCYM__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:386d52ab7c8e0f351a1367ccf46aac8531c83a2212ad304664b00aba06e027dd +size 32553753 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/NC__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/NC__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..cf27b6ab932149d7590c54728e46f6ceab8b96ac --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/NC__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:4553a150d227b0bf1e6c8f0154506c552d20e63191e01f807f69cf8f83917413 +size 6905262 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/NEVI__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/NEVI__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..028fcf105660406d8c57ed901163c3b1cd7945d6 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/NEVI__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:f222b4a4f0aaa897eb801af9f60abb85756d3722de92095a2225aba6106c9a5d +size 16226797 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/NKEKFFQH__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/NKEKFFQH__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..9cc5499df217c48725aa44752f9cc52282776886 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/NKEKFFQH__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:7cb114cdbe165117821bbe92d61b5ecb821408d27b0b87f9d46b192011709625 +size 36032529 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/NPCLCYML__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/NPCLCYML__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..6858e205c6d19d89f5f7efba07b97a4d072d2503 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/NPCLCYML__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:f83082f0cfbee59bec53b1ce0006f378c4733235332772bdb42d499523cc0554 +size 31060993 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/PG__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/PG__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..b8f1e2c673d1ff4eaeb6b8202186d10f41a4250e --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/PG__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:8fc2d6a184bf6037d8193406c4d373699d39c9479ac181406ba407b6f4f114b1 +size 5921297 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/PLFHVMYV__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/PLFHVMYV__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..40d87cb4daf6a4e16a45a9fb26cf1122ba24c9af --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/PLFHVMYV__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:1308891d17502243247517aa789e73d373e241bd00d090b81dfd4f24281a3061 +size 34344476 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/PPWRECNN__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/PPWRECNN__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..76b3dfa6a4661a27265c27eb8a76c7e4a7a828dd --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/PPWRECNN__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:2b843df3d1d3b454e99424c13ced8d518b72964118b7de53911d313b2731207e +size 32063310 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/PQIF__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/PQIF__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..8ae8e752e34d23ae3687624d701b2fc3bf2c005b --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/PQIF__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:8a4098dbb30d33f43217d4854c4125f744021ec5bd4eafd3dcb417391f71560a +size 17646981 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/PYIRNCVE__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/PYIRNCVE__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..1a38bafe2d71dfda5d1678b6ce8f82b7e516e3de --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/PYIRNCVE__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:38d5bb83a58b5cb6c2cbb7c31ee7749b83789ff5ac0d928afcaaf8cd031c31f9 +size 32967548 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/QAKR__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/QAKR__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..8fe10c7ba82d6a2af58395765b70a7511fd75558 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/QAKR__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:f341e71197d28524911fcaf0596c1333351df1df09fee877d471727573f69f95 +size 18383596 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/QR__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/QR__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..dded4fcb6673cd5a842cfe8554bab2d2eab10584 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/QR__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:62fa082460c41b41934ba19657dc77df99608e2790340b10c043ac4d630c4f64 +size 10737393 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/RL__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/RL__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..2da63ec88d813915c928979016fb332264bb7672 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/RL__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:746631c15dbb3ee06c3af65ddea667f64aedd7ebf995a700f72a882d263e6f05 +size 11187567 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/RT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/RT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..80ebce609c2fb8f3ed20121485853c4d919eb629 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/RT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:085183f7f8e92b3e27114b52cf0a3db1629d5eaa2cca8c6fbd19e370ca42f78f +size 10005660 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/SHKS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/SHKS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..408f556b57575010e6431d528192f823503cb19e --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/SHKS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:c8368041d88a7ccdd7ce4f5964081367fac8a3781948f0bb26020d715372e1cc +size 15513851 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/SPHKMRLC__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/SPHKMRLC__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..d7833cf0f50c924e3648577bc827dd6f53542c78 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/SPHKMRLC__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:82e1db3bbc60e96aaa61e44428118df2e6a4823f1598faff5341e69340225582 +size 33181786 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/SS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/SS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..d4e3bb2e187394f9956ca277b247eaada983f077 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/SS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:c13a4910a8c0190b4b78fbc8b151ee9c1866ac519effd913b458b2ef0849a168 +size 6168862 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/SVND__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/SVND__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..531229f4f007c4f02ea51263b5414d68071f9ee4 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/SVND__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:4b4194eecccf40bff859c979fe24dea9b188f0e042020ee7f1085e7503d9d24d +size 13615277 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/TD__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/TD__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..cfcb1f555141c774e3f5eeebadb1120aa596c524 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/TD__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:9f8b216b542729f009197dc27df8d1fa365339e69384801b763dac44cb077441 +size 7128600 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/TMWC__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/TMWC__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..5588bed4cfc9a77512e47a7b437a697aa7049b62 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/TMWC__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:f4e4a232d3098b5ba159ac4244f1c78850d6cefcb810d8bf3b3bed914250d786 +size 16734816 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/VF__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/VF__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..1fbcd9ea91bc986b59269826ec0e09402dcecbf3 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/VF__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:95f3f61830613babb84ce5173840fba018cef364dfe55397235b06ed742b3d81 +size 9505287 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/VPFY__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/VPFY__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..dafac6c089a6d2f118c1dc80845cfe7580c9f1c8 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/VPFY__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:b8451ab40d48b7b2e70bfc277d9c28b9b94e14882917d0429ca2fdf811753508 +size 17872823 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/VS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/VS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..9c664c285ec97748b2c45800e217093f2020f8ee --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/VS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:13af2f875c286545947b5e99c8d8beb892aaafff18700cd29f53729718f0b614 +size 7355132 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/VWIPVIDT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/VWIPVIDT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..6ab68a20f17d75ba9fd0587a8c142efe3cfc609f --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/VWIPVIDT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:6c8792769ae545432250e284a6d744b89936ccddb5804eec93385a1840e89679 +size 32915904 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/WA__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/WA__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..7da06d4029d6025eb8f26190d036ceec1faa6c69 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/WA__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:ae1762338565876969e8fd9936238a5c16b07b7bbd04bf2edf9915f3cb03851f +size 9044085 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/WH__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/WH__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..7a8adda7748f7e1c143bbebf48cd2c50885ddaa3 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/WH__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:404ffec8753717ed950b07fcd9ae7ce15736a3f11dc99fc5cc01703c977ba0da +size 10735400 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/WNMA__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/WNMA__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..56a9687b2360bd75620e253110e3305b5d846e96 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/WNMA__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:3d616c5b226b991ac129d880dafb7e3f82d3a05bc8c84870ba1888fb5780a420 +size 16478056 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/WQ__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/WQ__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..165a8f162a9bb21bc4302177803920cf87b7510d --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/WQ__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:f179843532a3b0e028e876d52b3bdfaf3a5d2f0536a8128124e0168a65847c61 +size 10736693 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/WTYAFAHS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/WTYAFAHS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..015b8d3f02b96cccacabec9b9b959e6be9822061 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/WTYAFAHS__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:e21aa0d0317e6d244763f1b7931f91c32270b68779b828766f2a4a2ad27095af +size 31302087 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/YC__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/YC__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..190ee63820f5fde5e1f869ade8780af801122e64 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/YC__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:fac72b36240ebadc76151a4ed175a98ee953e0353ce52e33f50177a992d61bee +size 8583354 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/YFPHAGYT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/YFPHAGYT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..d3397697cd5a58a77cca4ab030b19ff3374f3a48 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/YFPHAGYT__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:3f5a6e404df2a4f0dce970f58575541fc916b3a3c4204bb65a66b92e1f605f9c +size 30594017 diff --git a/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/YQNPDGSQA__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/YQNPDGSQA__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz new file mode 100644 index 0000000000000000000000000000000000000000..ef3180e765bce6c39f39a2f51f12cf9285eb0648 --- /dev/null +++ b/checkpoints/0_049B/core/01024_ws_scaling/dipper_0_049B_core_1024_ws_scaling_step_59080/YQNPDGSQA__Amber-ff14SB-in-OBC1-implicit-water__310K__intended.npz @@ -0,0 +1,3 @@ +version https://git-lfs.github.com/spec/v1 +oid sha256:d3c39a474ae46ebd477d3debeb21d6c3630dcc9f9e786208338d9a5cc76ab69f +size 30420796