{"id":5480,"date":"2025-08-28T16:37:17","date_gmt":"2025-08-28T07:37:17","guid":{"rendered":"https:\/\/matlantis.com\/ja\/?post_type=pfnblog&p=5480"},"modified":"2025-11-28T09:08:47","modified_gmt":"2025-11-28T00:08:47","slug":"acs-fall-2025-highlights","status":"publish","type":"pfnblog","link":"https:\/\/matlantis.com\/ja\/resources\/blog\/acs-fall-2025-highlights\/","title":{"rendered":"\u3010\u30a4\u30d9\u30f3\u30c8\u30ec\u30dd\u30fc\u30c8\u3011ACS Fall 2025\u306b\u51fa\u5c55\u30fb\u767a\u8868\u3057\u307e\u3057\u305f"},"content":{"rendered":"\n

\u5148\u65e5\u544a\u77e5<\/a>\u3055\u305b\u3066\u3044\u305f\u3060\u304d\u307e\u3057\u305f\u901a\u308a\u3001Matlantis\u682a\u5f0f\u4f1a\u793e\u306a\u3089\u3073\u306bPreferred Networks\u682a\u5f0f\u4f1a\u793e\u306f2025\u5e748\u670817\u65e5\u301c8\u670821\u65e5\u306b\u958b\u50ac\u3055\u308c\u305f\u300cACS Meetings & Expos \/ ACS Fall 2025\u300d\u306b\u53c2\u52a0\u3057\u3001\u30d6\u30fc\u30b9\u51fa\u5c55\u306a\u3089\u3073\u306b\u53e3\u982d\u30fb\u30dd\u30b9\u30bf\u30fc\u3067\u306e\u767a\u8868\u3092\u3057\u3066\u53c2\u308a\u307e\u3057\u305f\u3002\u4eca\u56de\u306f\u305d\u306e\u69d8\u5b50\u3092\u5199\u771f\u3092\u4ea4\u3048\u306a\u304c\u3089\u3054\u7d39\u4ecb\u3055\u305b\u3066\u3044\u305f\u3060\u304d\u307e\u3059\u3002
*\u306a\u304a\u5f0a\u793eUS\u30e1\u30f3\u30d0\u30fc\u306b\u3088\u308b\u30ec\u30dd\u30fc\u30c8\u3082\u63b2\u8f09<\/a>\u3044\u305f\u3057\u307e\u3057\u305f\u3002<\/span><\/p>\n\n\n\n

\u305d\u3082\u305d\u3082ACS Meetings & Expos\u3068\u306f\uff1f<\/strong><\/h2>\n\n\n\n

ACS Meetings & Expos<\/a>\u3068\u306f\u300123\u4e07\u4eba\u4ee5\u4e0a\u306e\u4f1a\u54e1\u3092\u64c1\u3059\u308b\u7c73\u56fd\u5316\u5b66\u4f1a\uff08American Chemical Society\uff09\u304c\u4e3b\u50ac\u3059\u308b\u3001\u4e16\u754c\u6700\u5927\u7d1a\u306e\u5316\u5b66\u5206\u91ce\u306e\u5b66\u8853\u30a4\u30d9\u30f3\u30c8\u3002
\u5e74\u306b2\u56de\uff08\u6625\u3068\u79cb\uff09\u958b\u50ac\u3055\u308c\u3001\u958b\u50ac\u5e74\u306b\u3088\u3063\u3066\u306f15,000\u4eba\u3092\u8d85\u3048\u308b\u4e16\u754c\u4e2d\u306e\u7814\u7a76\u8005\u3001\u4f01\u696d\u4eba\u3001\u5b66\u751f\u304c\u4e00\u5802\u306b\u4f1a\u3057\u307e\u3059\u3002
\u671f\u9593\u4e2d\u306f\u3001\u30ce\u30fc\u30d9\u30eb\u8cde\u53d7\u8cde\u8005\u306b\u3088\u308b\u57fa\u8abf\u8b1b\u6f14\u3001\u6700\u5148\u7aef\u306e\u6280\u8853\u30bb\u30c3\u30b7\u30e7\u30f3\u3001\u7279\u5b9a\u306e\u30c6\u30fc\u30de\u3092\u6df1\u6398\u308a\u3059\u308b\u30b7\u30f3\u30dd\u30b8\u30a6\u30e0\u3001\u7814\u7a76\u8005\u304c\u30dd\u30b9\u30bf\u30fc\u5f62\u5f0f\u3067\u767a\u8868\u3059\u308b\u30bb\u30c3\u30b7\u30e7\u30f3\u306a\u3069\u3001\u591a\u5c90\u306b\u308f\u305f\u308b\u30d7\u30ed\u30b0\u30e9\u30e0\u304c\u7d44\u307e\u308c\u3066\u3044\u308b\u4ed6\u3001\u5f0a\u793eMatlantis\u3092\u542b\u3081\u3001\u6700\u65b0\u306e\u5206\u6790\u6a5f\u5668\u3084\u30bd\u30d5\u30c8\u30a6\u30a7\u30a2\u306a\u3069\u3092\u6271\u3046\u591a\u304f\u306e\u4f01\u696d\u304c\u30d6\u30fc\u30b9\u3092\u8a2d\u55b6\u3002
\u5358\u306a\u308b\u7814\u7a76\u767a\u8868\u306e\u5834\u306b\u7559\u307e\u3089\u305a\u3001\u4e16\u754c\u4e2d\u306e\u5316\u5b66\u30b3\u30df\u30e5\u30cb\u30c6\u30a3\u306e\u30cf\u30d6\u3068\u3057\u3066\u3001\u65b0\u305f\u306a\u5171\u540c\u7814\u7a76\u306e\u6a5f\u4f1a\u5275\u51fa\u3084\u3001\u7523\u696d\u754c\u3068\u5b66\u8853\u754c\u306e\u30cd\u30c3\u30c8\u30ef\u30fc\u30ad\u30f3\u30b0\u3092\u4fc3\u9032\u3059\u308b\u91cd\u8981\u306a\u5f79\u5272\u3092\u62c5\u3063\u3066\u3044\u308b\u30a4\u30d9\u30f3\u30c8\u3067\u3059\u3002<\/p>\n\n\n\n

\"image1_ACS<\/figure>\n\n\n\n

<\/p>\n\n\n\n

\u30a4\u30d9\u30f3\u30c8\u306e\u69d8\u5b50<\/strong><\/h2>\n\n\n\n

\u30fb\u4f1a\u5834<\/h4>\n\n\n\n

ACS Fall 2025\u306e\u4f1a\u5834\u306f\u3001\u30ef\u30b7\u30f3\u30c8\u30f3DC\u306b\u3042\u308b\u300cWalter E. Washington Convention Center\u300d\u3067\u3057\u305f \u3002
\u5e83\u5927\u306a\u4f1a\u5834\u306f5\u65e5\u9593\u306b\u308f\u305f\u308a\u4e16\u754c\u4e2d\u304b\u3089\u96c6\u307e\u3063\u305f\u591a\u304f\u306e\u7814\u7a76\u8005\u305f\u3061\u306e\u71b1\u6c17\u306b\u5305\u307e\u308c\u3001\u81f3\u308b\u6240\u3067\u6700\u65b0\u306e\u7814\u7a76\u6210\u679c\u3092\u5de1\u308b\u6d3b\u767a\u306a\u8b70\u8ad6\u304c\u4ea4\u308f\u3055\u308c\u3066\u3044\u307e\u3057\u305f\u3002<\/p>\n\n\n\n

\"image2_ACS<\/figure>\n\n\n\n

<\/p>\n\n\n\n

\u30fb\u30d6\u30fc\u30b9<\/h4>\n\n\n\n

Matlantis\u306f\u5c55\u793a\u30db\u30fc\u30eb\u306b\u3066\u30d6\u30fc\u30b9\u3092\u51fa\u5c55\u3044\u305f\u3057\u307e\u3057\u305f\u3002
\u4f1a\u671f\u4e2d\u306f\u30a2\u30e1\u30ea\u30ab\u3092\u4e2d\u5fc3\u3068\u3057\u305f\u4e16\u754c\u4e2d\u306e\u5927\u5b66\u3084\u591a\u304f\u306e\u4f01\u696d\u306e\u7814\u7a76\u8005\u306e\u65b9\u3005\u306b\u304a\u7acb\u3061\u5bc4\u308a\u3044\u305f\u3060\u304d\u3001Matlantis\u306e\u6280\u8853\u3084\u53d6\u308a\u7d44\u307f\u306b\u3064\u3044\u3066\u3054\u7d39\u4ecb\u3057\u307e\u3057\u305f\u3002
\"image3_ACS
\u5f0a\u793e\u65e5\u672c\u30aa\u30d5\u30a3\u30b9\u306eRudy\u3001US\u30aa\u30d5\u30a3\u30b9\u306eJoshua<\/span>\u3001Qingjie<\/span>\u304cMatlantis\u30d6\u30fc\u30b9\u306b\u3066\u30c7\u30a3\u30b9\u30ab\u30c3\u30b7\u30e7\u30f3\u3057\u3066\u3044\u308b\u69d8\u5b50<\/p>\n\n\n\n

\u30d7\u30ec\u30bc\u30f3\u30c6\u30fc\u30b7\u30e7\u30f3\u306e\u69d8\u5b50<\/strong><\/h2>\n\n\n\n

\u4eca\u56deMatlantis\u304b\u3089\u306f2\u540d\u306e\u30e1\u30f3\u30d0\u30fc\u304c\u30dd\u30b9\u30bf\u30fc\u767a\u8868\u3092\u884c\u3044\u307e\u3057\u305f\u3002\u307e\u305fPFP\u306e\u958b\u767a\u5143\u3067\u3042\u308bPFN\u304b\u3089\u3082\u3001Matlantis\u306b\u95a2\u9023\u3057\u3066\u53e3\u982d\u767a\u8868\uff11\u4ef6\u3001\u30dd\u30b9\u30bf\u30fc\u767a\u88681\u4ef6\u3092\u5b9f\u65bd\u3057\u307e\u3057\u305f\u3002<\/p>\n\n\n\n

\u30fb\u6ce8\u76ee\u3092\u96c6\u3081\u305f\u53e3\u982d\u767a\u8868<\/h4>\n\n\n\n

PFN\u306e\u6797\u3088\u308a\u300cAutomated generation of reaction pathways using neural networks\u300d\u3068\u3044\u3046\u30bf\u30a4\u30c8\u30eb\u3067\u306e\u53e3\u982d\u767a\u8868\u3092\u5b9f\u65bd\u3002
\u3053\u306e\u767a\u8868\u3067\u306f\u3001\u5316\u5b66\u53cd\u5fdc\u7d4c\u8def\u767a\u898b\u306e\u5b8c\u5168\u81ea\u52d5\u5316\u306e\u9375\u3068\u306a\u308b\u300c\u7121\u6761\u4ef6\u751f\u6210\u300d\u306b\u304a\u3044\u3066\u3001\u5f93\u6765\u624b\u6cd5\u306e\u8ab2\u984c\uff08\u53cd\u5fdc\u539f\u5b50\u306e\u6307\u5b9a\u306a\u3069\uff09\u3092\u514b\u670d\u3059\u308b\u305f\u3081\u306e\u3001RCG\u306b\u7740\u60f3\u3092\u5f97\u305f\u65b0\u30a2\u30d7\u30ed\u30fc\u30c1\u306e\u521d\u671f\u7d50\u679c\u3084\u5927\u898f\u6a21\u306a\u7cfb<\/span>\u3092\u5831\u544a\u3057\u3001\u4f1a\u5834\u306e\u6ce8\u76ee\u3092\u96c6\u3081\u307e\u3057\u305f\u3002
\"image4_ACS<\/p>\n\n\n\n

\u30fb\u6d3b\u767a\u306a\u8b70\u8ad6\u304c\u4ea4\u308f\u3055\u308c\u305f\u30dd\u30b9\u30bf\u30fc\u767a\u8868<\/h4>\n\n\n\n

\u5408\u8a08\u30673\u4ef6\u306e\u30dd\u30b9\u30bf\u30fc\u767a\u8868\u3092\u884c\u3044\u3001\u591a\u304f\u306e\u65b9\u306b\u8db3\u3092\u6b62\u3081\u3066\u3044\u305f\u3060\u304d\u307e\u3057\u305f\u3002<\/p>\n\n\n\n

PFP\u306e\u958b\u767a\u8005\u306e\u4e00\u4eba\u3067\u3042\u308bPFN\u306e\u54c1\u5ddd\u304b\u3089\u306f\u3001PFP v8\u5411\u3051\u306b\u65b0\u305f\u306b\u958b\u767a\u3055\u308c\u305fR2SCAN\u30e2\u30fc\u30c9\u306b\u3064\u3044\u3066\u30dd\u30b9\u30bf\u30fc\u767a\u8868\u3092\u884c\u3044\u3001\u6d3b\u767a\u306a\u8b70\u8ad6\u304c\u4ea4\u308f\u3055\u308c\u307e\u3057\u305f\u3002
\"image5_ACS
\u30dd\u30b9\u30bf\u30fc\u306e\u524d\u3067\u8b70\u8ad6\u3059\u308b\u54c1\u5ddd\uff08\u753b\u9762\u5de6\uff09<\/p>\n\n\n\n

\u307e\u305fMatlantis\u306e\u7c73\u6fa4\u3068\u540d\u5150\u8036\u304b\u3089\u306f\u3001\u305d\u308c\u305e\u308c\u4ee5\u4e0b\u306e\u30c6\u30fc\u30de\u3067\u30dd\u30b9\u30bf\u30fc\u767a\u8868\u3092\u884c\u3044\u307e\u3057\u305f \u3002
\u30fb\uff62NMR chemical shift prediction with PFP descriptor: An application of universal machine learning interatomic potential\uff63 (\u7c73\u6fa4)
\u30fb\u300cApplication of a universal graph neural network potential for molecular dynamics of liquid phases\u300d (\u540d\u5150\u8036)
\"image6_ACS
\u7c73\u6fa4\u767a\u8868\u306e\u30dd\u30b9\u30bf\u30fc\u3002\u3053\u3061\u3089\u306b\u3082\u591a\u304f\u306e\u65b9\u3005\u306b\u304a\u8d8a\u3057\u3044\u305f\u3060\u304d\u307e\u3057\u305f\u3002<\/p>\n\n\n\n

\u304a\u308f\u308a\u306b<\/strong><\/h2>\n\n\n\n

\u4eca\u56de\u306eACS Fall 2025\u3078\u306e\u53c2\u52a0\u306f\u3001\u5358\u306bMatlantis\u306e\u6280\u8853\u3092\u3054\u7d39\u4ecb\u3059\u308b\u3060\u3051\u3067\u306a\u304f\u3001\u4e16\u754c\u4e2d\u304b\u3089\u96c6\u307e\u3063\u305f\u3001\u512a\u308c\u305f\u6210\u679c\u3092\u51fa\u3059\u591a\u304f\u306e\u7814\u7a76\u8005\u306e\u7686\u69d8\u3068\u76f4\u63a5\u304a\u8a71\u3057\u3001\u6d3b\u767a\u306a\u8b70\u8ad6\u3092\u4ea4\u308f\u3059\u8cb4\u91cd\u306a\u6a5f\u4f1a\u3068\u306a\u308a\u307e\u3057\u305f \u3002\u30d6\u30fc\u30b9\u3084\u767a\u8868\u306b\u8db3\u3092\u904b\u3093\u3067\u304f\u3060\u3055\u3063\u305f\u7686\u69d8\u3001\u8aa0\u306b\u3042\u308a\u304c\u3068\u3046\u3054\u3056\u3044\u307e\u3057\u305f \u3002
\u3053\u3046\u3057\u305f\u7b2c\u4e00\u7dda\u306e\u7814\u7a76\u8005\u306e\u65b9\u3005\u3068\u306e\u4ea4\u6d41\u306f\u3001\u5f0a\u793e\u306e\u6d3b\u52d5\u3092\u5b66\u8853\u5206\u91ce\u306e\u767a\u5c55\u306b\u8ca2\u732e\u3055\u305b\u3066\u3044\u304f\u4e0a\u3067\u3082\u975e\u5e38\u306b\u6709\u610f\u7fa9\u306a\u3082\u306e\u3067\u3059\u3002Matlantis\u306f\u4eca\u5f8c\u3082\u3053\u306e\u3088\u3046\u306a\u5834\u3092\u901a\u3058\u3066\u5f97\u305f\u65b0\u305f\u306a\u77e5\u898b\u3092\u6d3b\u304b\u3057\u3001\u304a\u5ba2\u69d8\u306e\u8ab2\u984c\u89e3\u6c7a\u306b\u8ca2\u732e\u3059\u308b\u305f\u3081\u3001\u7d99\u7d9a\u7684\u306b\u6700\u65b0\u306e\u6280\u8853\u958b\u767a\u3092\u63a8\u9032\u3057\u3066\u307e\u3044\u308a\u307e\u3059\u3002<\/p>\n\n\n\n

\u5f15\u304d\u7d9a\u304dMatlantis\u306f\u3001\u4e16\u754c\u4e2d\u306e\u7814\u7a76\u8005\u306e\u7686\u69d8\u306e\u7814\u7a76\u3092\u52a0\u901f\u3055\u305b\u3001\u7814\u7a76\u30b9\u30bf\u30a4\u30eb\u306e\u5909\u9769\u3092\u5b9f\u73fe\u3059\u308b\u3053\u3068\u306b\u5c3d\u529b\u3057\u307e\u3059\u3002<\/p>\n\n\n\n

\"image7_ACS
\u5f0a\u793e\u65e5\u672c\u30aa\u30d5\u30a3\u30b9\u304a\u3088\u3073PFN\u306e\u3001\u6700\u5148\u7aef\u3092\u8d70\u308b\u30ea\u30b5\u30fc\u30c1\u30e3\u30fc\u304a\u3088\u3073\u30ab\u30b9\u30bf\u30de\u30fc\u30b5\u30af\u30bb\u30b9\u30a8\u30f3\u30b8\u30cb\u30a2\u306e\u9762\u3005<\/p>\n\n\n\n

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