review article | Q7318358 |
scholarly article | Q13442814 |
P356 | DOI | 10.1080/10629360310001673917 |
P698 | PubMed publication ID | 14758976 |
P50 | author | Peter Ertl | Q27768873 |
P2093 | author name string | Selzer P | |
Rohde B | |||
Mühlbacher J | |||
P2860 | cites work | Molecular properties that influence the oral bioavailability of drug candidates | Q34130727 |
ADMET in silico modelling: towards prediction paradise? | Q35075770 | ||
Lipophilicity force field profile: an expressive visualization of the lipophilicity molecular potential gradient. | Q52473295 | ||
Cheminformatics Analysis of Organic Substituents: Identification of the Most Common Substituents, Calculation of Substituent Properties, and Automatic Identification of Drug-like Bioisosteric Groups | Q56032354 | ||
Simple Quantum Chemical Parameters as an Alternative to the Hammett Sigma Constants in QSAR Studies | Q56919111 | ||
WWW-based chemical information system | Q56919117 | ||
Handbook of Molecular Descriptors | Q62968825 | ||
Atomic physicochemical parameters for three dimensional structure directed quantitative structure-activity relationships. 4. Additional parameters for hydrophobic and dispersive interactions and their application for an automated superposition of ... | Q108523054 | ||
Fast Calculation of Molecular Polar Surface Area as a Sum of Fragment-Based Contributions and Its Application to the Prediction of Drug Transport Properties | Q28842810 | ||
World Wide Web-based system for the calculation of substituent parameters and substituent similarity searches | Q31995260 | ||
P433 | issue | 5-6 | |
P921 | main subject | cheminformatics | Q910164 |
molecular design | Q55213915 | ||
P304 | page(s) | 321-328 | |
P577 | publication date | 2003-10-01 | |
P1433 | published in | SAR and QSAR in Environmental Research | Q15724562 |
P1476 | title | Web-based cheminformatics and molecular property prediction tools supporting drug design and development at Novartis | |
P478 | volume | 14 |
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Q27702175 | JSME: a free molecule editor in JavaScript |
Q57186127 | Molecular dynamic simulations of the metallo-beta-lactamase from Bacteroides fragilis in the presence and absence of a tight-binding inhibitor |
Q27499199 | Molecular structure input on the web |
Q26863371 | Non-systemic drugs: a critical review |
Q33236305 | Optimizing the use of open-source software applications in drug discovery |
Q56918982 | Polar Surface Area |
Q56919051 | Web-based cheminformatics tools deployed via corporate Intranets |
Q30485497 | Web-based services for drug design and discovery |
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