Advanced strategy for ab initio structure determination of pharmaceutical compounds by powder data

被引：0

作者：

Sakata, Makoto ^{[1
,2
]}

Nishibori, Eiji ^{[2
]}

Aoyagi, Shinobu ^{[2
]}

机构：

[1] SPring 8, Japan Synchrotron Radiat Res Inst, Sayou, Hyogo 6795198, Japan

[2] Nagoya Univ, Dept Appl Phys, Chikusa Ku, Nagoya, Aichi, Japan

来源：

ACTA CRYSTALLOGRAPHICA A-FOUNDATION AND ADVANCES | 2008年 / 64卷

关键词：

structure determination from powder diffraction; maximum entropy method; pharmaceutical compounds;

D O I：

10.1107/S010876730809332X

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

P02.11.27

引用

页码：C208 / C208

页数：1

共 50 条

[21] A selective instant synthesis of a coordination network and its ab initio powder structure determination
Kawano, Masaki
Haneda, Tsuyoshi
Hashizume, Daisuke
Izumi, Fujio
Fujita, Makoto
ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 2008, 47 (07) : 1269 - 1271
[22] 3-Benzyloxybenzaldehyde: Ab initio powder structure determination and Hirshfeld surface analysis
Das, Uday
Chattopadhyay, Basab
Mukherjee, Monika
Mukherjee, Alok K.
ZEITSCHRIFT FUR KRISTALLOGRAPHIE-CRYSTALLINE MATERIALS, 2013, 228 (11): : 583 - 589
[23] The ab initio structure determination of Sigma-2 (a new clathrasil phase) from synchrotron powder diffraction data
McCusker, L.
Journal of Applied Crystallography, 1988, 21 (04): : 305 - 310
[24] Ab initio structure determination of ammonium hydrogen alkyl phosphates from X-ray powder diffraction data
Neels, A
Stoeckli-Evans, H
Neels, J
Clearfield, A
Poojary, D
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE, 1998, 54 : 478 - 484
[25] Ab Initio Structure Determination of Anhydrous Sodium Alendronate from Laboratory Powder X-Ray Diffraction Data
Asnani, Minakshi
Vyas, K.
Bhattacharya, Apurba
Devarakonda, Surya
Chakraborty, Santu
Mukherjee, Alok Kumar
JOURNAL OF PHARMACEUTICAL SCIENCES, 2009, 98 (06) : 2113 - 2121
[26] Ab initio structure determination of ammonium hydrogen alkyl phosphates from X-ray powder diffraction data
Neels, A.
Stoeckli-Evans, H.
Neels, J.
Clearfield, A.
Poojary, D.
Acta Crystallographica, Section B: Structural Science, 1998, 54 (pt 4):
[27] Ab initio structure determination of sulfathiazole polymorph V from synchrotron X-ray powder diffraction data
Chan, FC
Anwar, J
Cernik, R
Barnes, P
Wilson, RM
JOURNAL OF APPLIED CRYSTALLOGRAPHY, 1999, 32 : 436 - 441
[28] Ab Initio Structure Determination of Ammonium Hydrogen Alkyl Phosphates from X-ray Powder Diffraction Data
Institut de Chimie, Université de Neuchâtel, Avenue de Bellevaux 51, CH-2000 Neuchâtel, Switzerland
不详
不详
Acta Crystallogr. Sect. B Struct. Sci., 4 (478-484):
[29] Ab initio structure solution from powder diffraction data using charge flipping
Baerlocher, Ch.
McCusker, L. B.
Palatinus, L.
ACTA CRYSTALLOGRAPHICA A-FOUNDATION AND ADVANCES, 2006, 62 : S231 - S231
[30] Ab initio structure determination of Li2MnO3 from X-ray powder diffraction data
Massarotti, V
Bini, M
Capsoni, D
Altomare, A
Moliterni, AGG
JOURNAL OF APPLIED CRYSTALLOGRAPHY, 1997, 30 : 123 - 127

← 1 2 3 4 5 →