battery results: still summary gains the resolution of our merge and of the deposition
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Co-Authored-By: Claude Opus 5.5 <noreply@anthropic.com>
Claude-Session: https://claude.ai/code/session_015CeEGgpKdfkCTJb3YNMJcu
This commit is contained in:
leonarski_fandClaude Opus 5.5 committed 2026-10-22 14:53:33 +02:00
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commit 4858816e2a
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+16 -15
@@ -9,25 +9,26 @@ input evicted from the page cache first), one set at a time, nothing else runnin
coefficients; **rate** = images / time, start-up included.
- **R_free**: REFMAC on the deposited model as deposited, NOT refined (first rigid-body cycle before any
shift: bulk solvent and anisotropic scale only), the deposition's free set, the reflections both data
sets share, at the lower of the two resolutions. "ours" uses our merge, "deposited SFs" the deposited
sets share, at the lower of the two resolutions. **d_min ours** is rugnux's own
cut (CC1/2), **deposited** the deposition's high-resolution limit. "ours" uses our merge, "deposited SFs" the deposited
structure factors through the same protocol. Win / loss = more than 0.01 apart; draw otherwise.
- Each set is given the deposition's cell and space group (`-C`/`-S`); three sets are still given a
detector distance (PAL 86, LCLS 222, LCLS 242) - see the commands in report.md.
| dataset (CXIDB) | facility, detector | images used | images behind the deposition | time | rate | R_free ours | R_free deposited SFs | difference | |
|---|---|---|---|---|---|---|---|---|---|
| SACLA 243 | SACLA BL2, MPCCD | 52,151 | 52,151 | 295 s | 177 Hz | 0.196 | 0.208 | -0.012 | win |
| SACLA 237 (dark) | SACLA BL2, MPCCD | 10,789 | ~600,000 hits | 92 s | 117 Hz | 0.223 | 0.216 | +0.007 | draw |
| SACLA 236 | SACLA BL2, MPCCD | 16,083 | 16,083 | 111 s | 145 Hz | 0.195 | 0.237 | -0.042 | win |
| PAL 86 | PAL-XFEL NCI, Rayonix MX225-HS | 46,900 | whole entry (one truncated file left out) | 116 s | 404 Hz | 0.203 | 0.212 | -0.008 | draw |
| PAL 90 | PAL-XFEL NCI, Rayonix MX225-HS | 79,805 | 79,805 hits (29,157 indexed) | 161 s | 494 Hz | 0.201 | 0.238 | -0.037 | win |
| LCLS 222 | LCLS MFX, Rayonix MX340-HS | 8,534 | runs 165-168 (we use 165) | 28 s | 308 Hz | 0.200 | 0.205 | -0.006 | draw |
| LCLS 242 form S | LCLS MFX, Rayonix MX340-HS | 82,388 | runs 256-310+ (we use 256-267) | 251 s | 328 Hz | 0.237 | 0.253 | -0.016 | win |
| LCLS 242 form T | LCLS MFX, Rayonix MX340-HS | 82,388 | same | 260 s | 317 Hz | 0.309 | 0.253 | +0.056 | loss |
| EuXFEL 83 | EuXFEL SPB/SFX, AGIPD 1M | 14,445 | 14,445 | 358 s | 40 Hz | 0.230 | 0.220 | +0.010 | loss |
| EuXFEL 152 | EuXFEL SPB/SFX, AGIPD 1M | 33,528 | 37,006 | 794 s | 42 Hz | 0.254 | 0.244 | +0.009 | draw |
| Alvra 213 MbCO dark (int16) | SwissFEL Alvra, JUNGFRAU 4M | 28,428 | whole dark series | 44 s | 649 Hz | 0.211 | 0.227 | -0.016 | win |
| Alvra 103 A2A (int16) | SwissFEL Alvra, JUNGFRAU 16M | 53,734 | 199,136 indexed | 84 s | 638 Hz | 0.253 | 0.264 | -0.011 | win |
| dataset (CXIDB) | facility, detector | images used | images behind the deposition | d_min ours / deposited (A) | time | rate | R_free ours | R_free deposited SFs | difference | |
|---|---|---|---|---|---|---|---|---|---|---|
| SACLA 243 | SACLA BL2, MPCCD | 52,151 | 52,151 | 1.44 / 1.63 | 295 s | 177 Hz | 0.196 | 0.208 | -0.012 | win |
| SACLA 237 (dark) | SACLA BL2, MPCCD | 10,789 | ~600,000 hits | 2.35 / 2.05 | 92 s | 117 Hz | 0.223 | 0.216 | +0.007 | draw |
| SACLA 236 | SACLA BL2, MPCCD | 16,083 | 16,083 | 1.59 / 1.68 | 111 s | 145 Hz | 0.195 | 0.237 | -0.042 | win |
| PAL 86 | PAL-XFEL NCI, Rayonix MX225-HS | 46,900 | whole entry (one truncated file left out) | 1.53 / 1.80 | 116 s | 404 Hz | 0.203 | 0.212 | -0.008 | draw |
| PAL 90 | PAL-XFEL NCI, Rayonix MX225-HS | 79,805 | 79,805 hits (29,157 indexed) | 1.53 / 1.75 | 161 s | 494 Hz | 0.201 | 0.238 | -0.037 | win |
| LCLS 222 | LCLS MFX, Rayonix MX340-HS | 8,534 | runs 165-168 (we use 165) | 1.65 / 1.65 | 28 s | 308 Hz | 0.200 | 0.205 | -0.006 | draw |
| LCLS 242 form S | LCLS MFX, Rayonix MX340-HS | 82,388 | runs 256-310+ (we use 256-267) | 1.84 / 1.95 | 251 s | 328 Hz | 0.237 | 0.253 | -0.016 | win |
| LCLS 242 form T | LCLS MFX, Rayonix MX340-HS | 82,388 | same | 2.60 / 1.95 | 260 s | 317 Hz | 0.309 | 0.253 | +0.056 | loss |
| EuXFEL 83 | EuXFEL SPB/SFX, AGIPD 1M | 14,445 | 14,445 | 1.60 / 1.69 | 358 s | 40 Hz | 0.230 | 0.220 | +0.010 | loss |
| EuXFEL 152 | EuXFEL SPB/SFX, AGIPD 1M | 33,528 | 37,006 | 2.45 / 2.80 | 794 s | 42 Hz | 0.254 | 0.244 | +0.009 | draw |
| Alvra 213 MbCO dark (int16) | SwissFEL Alvra, JUNGFRAU 4M | 28,428 | whole dark series | 1.26 / 1.35 | 44 s | 649 Hz | 0.211 | 0.227 | -0.016 | win |
| Alvra 103 A2A (int16) | SwissFEL Alvra, JUNGFRAU 16M | 53,734 | 199,136 indexed | 2.45 / 2.65 | 84 s | 638 Hz | 0.253 | 0.264 | -0.011 | win |
6 wins, 4 draws, 2 losses on 12 sets.