Results 221 to 230 of about 3,015,044 (288)

Use of TLC and Computational Methods to Determine Lipophilicity Parameters of Selected Neuroleptics: Comparison of Experimental and Theoretical Studies. [PDF]

Pharmaceuticals (Basel)
Klimoszek D, Dołowy M, Jeleń M, Bober-Majnusz K.   +3 more
europepmc   +1 more source

Predicting Atomic Charges in MOFs by Topological Charge Equilibration

Advanced Functional Materials, EarlyView.
An atomic charge prediction method is presented that is able to accurately reproduce ab‐initio‐derived reference charges for a large number of metal–organic frameworks. Based on a topological charge equilibration scheme, static charges that fulfill overall neutrality are quickly generated.
Babak Farhadi Jahromi, Sumukh Shankar Sharadaprasad, Rochus Schmid   +2 more
wiley   +1 more source

Editorial: Experimental and computational methods in the development of diagnostics and therapeutics for colon cancer. [PDF]

Front Mol Biosci
Suleman M, Ali S, Rashid F, Khan FI.
europepmc   +1 more source

Punica granatum leaf extract as a natural antibacterial agent explored by experimental and computational methods. [PDF]

Sci Rep
Tasnim F, Hosen ME, Hasan AR, Hasan MT, Rahaman MM, Hossain MM, Jubayed MAA, Aktaruzzaman M, Altayyar M, Yihune E, Islam MT, Zaki MEA.   +11 more
europepmc   +1 more source

Comparative Evaluation of Computational Methods for Validating Housekeeping Gene RT-qPCR Data in 3T3-L1 Cells. [PDF]

Biomedicines
Ivanova Z, Grigorova N, Petrova V, Vachkova E, Beev G.   +4 more
europepmc   +1 more source

Computational methods for allele-specific expression in single cells. [PDF]

Trends Genet
Qi G, Battle A.
europepmc   +1 more source

Computational Methods for Modeling Lipid-Mediated Active Pharmaceutical Ingredient Delivery. [PDF]

Mol Pharm
Paloncýová M, Valério M, Dos Santos RN, Kührová P, Šrejber M, Čechová P, Dobchev DA, Balsubramani A, Banáš P, Agarwal V, Souza PCT, Otyepka M.   +11 more
europepmc   +1 more source