From owner-chemistry@ccl.net Thu Aug 24 14:25:00 2017 From: "Gilson, Michael mgilson(-)ucsd.edu" To: CCL Subject: CCL: SAMPL6 Host-Guest Prediction Challenge Now Open Message-Id: <-52951-170824141925-27860-XBT8h2NpYnYvnOzPtFlqxA-,-server.ccl.net> X-Original-From: "Gilson, Michael" Content-Language: en-US Content-Type: multipart/alternative; boundary="_000_32B906290392624AA8A7BA3FDFB5079E010D43AF2Fxmailmbxbv2AD_" Date: Thu, 24 Aug 2017 18:19:19 +0000 MIME-Version: 1.0 Sent to CCL by: "Gilson, Michael" [mgilson]^[ucsd.edu] --_000_32B906290392624AA8A7BA3FDFB5079E010D43AF2Fxmailmbxbv2AD_ Content-Type: text/plain; charset="Windows-1252" Content-Transfer-Encoding: quoted-printable Dear Colleagues, We are excited to announce that the SAMPL6 host-guest challenge is now open= ! Details and a link to the data package are available at the D3R SAMPL6 page= . Note that, unlike in prior chall= enges, the data package is now being provided via GitHub. This is because the D3R site is being updated, and also= to facilitate revision control. If you want to join SAMPL6, please sign u= p on not only the D3R site, but also the GitHub site (=93watch=94 the repos= itory), to make sure you receive all relevant notifications. We will send out further announcements when the physical properties and SAM= PLing components of SAMPL6 open. Sincerely, SAMPL and D3R Organizers P.S. Apologies for any cross-postings --_000_32B906290392624AA8A7BA3FDFB5079E010D43AF2Fxmailmbxbv2AD_ Content-Type: text/html; charset="Windows-1252" Content-Transfer-Encoding: quoted-printable Dear Colleagues,

We are excited to announce that the SAMPL6 host-guest challenge is now open= !

Details and a link to the data package are available at the D3R SAMPL6 page. Note that, unlike in prior challenges, the data package is now being provi= ded via GitHub. This is because the D3R site is being updated, and also to facilitate revi= sion control.  If you want to join SAMPL6, please sign up on not only = the D3R site, but also the GitHub site (=93watch=94 the repository), to mak= e sure you receive all relevant notifications.

We will send out further announcements when the physical properties and SAM= PLing components of SAMPL6 open.

Sincerely,
SAMPL and D3R Organizers

P.S. Apologies for any cross-postings

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